 | | 6S4 | | Name: | (3~{S})-~{N}-~{tert}-butyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide | | Formula: | C14 H20 N2 O | | SMILES: | CC(C)(C)NC(=O)[CH]1Cc2ccccc2CN1 | | InChi: | InChI=1S/C14H20N2O/c1-14(2,3)16-13(17)12-8-10-6-4-5-7-11(10)9-15-12/h4-7,12,15H,8-9H2,1-3H3,(H,16,17)/t12-/m0/s1 | | Definition date: | 2016-06-10 | | Last modified: | 2016-07-08 | | Release date: | 2016-07-13 | | Identifier: | (3~{S})-~{N}-~{tert}-butyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
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 | | H27 | | Name: | (2R)-2-[{(E)-2-[({(2R,3R,4R,5S,6R)-3-(acetylamino)-4,5-bis(acetyloxy)-6-[(acetyloxy)methyl]tetrahydro-2H-pyran-2-yl}carbamothioyl)amino]ethenyl}(biphenyl-4-ylsulfonyl)amino]-3-methylbutanoic acid | | Formula: | C34 H42 N4 O12 S2 | | SMILES: | c2c(S(N(/C=C/NC(NC1C(C(OC(=O)C)C(OC(=O)C)C(COC(=O)C)O1)NC(=O)C)=S)C(C(O)=O)C(C)C)(=O)=O)ccc(c2)c3ccccc3 | | InChi: | InChI=1S/C34H42N4O12S2/c1-19(2)29(33(43)44)38(52(45,46)26-14-12-25(13-15-26)24-10-8-7-9-11-24)17-16-35-34(51)37-32-28(36-20(3)39)31(49-23(6)42)30(48-22(5)41)27(50-32)18-47-21(4)40/h7-17,19,27-32H,18H2,1-6H3,(H,36,39)(H,43,44)(H2,35,37,51)/b17-16+/t27-,28-,29-,30-,31-,32-/m1/s1 | | Definition date: | 2016-02-27 | | Last modified: | 2016-07-01 | | Release date: | 2016-07-06 | | Identifier: | (2R)-2-[{(E)-2-[({(2R,3R,4R,5S,6R)-3-(acetylamino)-4,5-bis(acetyloxy)-6-[(acetyloxy)methyl]tetrahydro-2H-pyran-2-yl}carbamothioyl)amino]ethenyl}(biphenyl-4-ylsulfonyl)amino]-3-methylbutanoic acid (non-preferred name) |
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 | | 67F | | Name: | (2S)-2-{[2-({[(2R,3R,4R,5S,6R)-3-(acetylamino)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]carbamothioyl}amino)ethyl](biphenyl-4-ylsulfonyl)amino}-3-methylbutanoic acid (non-preferred name) | | Formula: | C28 H38 N4 O9 S2 | | SMILES: | O=C(NC1C(OC(C(C1O)O)CO)NC(NCCN(S(=O)(=O)c2ccc(cc2)c3ccccc3)C(C(C)C)C(O)=O)=S)C | | InChi: | InChI=1S/C28H38N4O9S2/c1-16(2)23(27(37)38)32(43(39,40)20-11-9-19(10-12-20)18-7-5-4-6-8-18)14-13-29-28(42)31-26-22(30-17(3)34)25(36)24(35)21(15-33)41-26/h4-12,16,21-26,33,35-36H,13-15H2,1-3H3,(H,30,34)(H,37,38)(H2,29,31,42)/t21-,22-,23+,24-,25-,26-/m1/s1 | | Definition date: | 2016-02-11 | | Last modified: | 2016-07-01 | | Release date: | 2016-07-06 | | Identifier: | (2S)-2-{[2-({[(2R,3R,4R,5S,6R)-3-(acetylamino)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]carbamothioyl}amino)ethyl](biphenyl-4-ylsulfonyl)amino}-3-methylbutanoic acid (non-preferred name) |
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 | | 67M | | Name: | (2R)-2-[({1-[3-({(2R,3R,4R,5S,6R)-3-(acetylamino)-4,5-bis(acetyloxy)-6-[(acetyloxy)methyl]tetrahydro-2H-pyran-2-yl}oxy)propyl]-1H-1,2,3-triazol-4-yl}methyl)(biphenyl-4-ylsulfonyl)amino]-3-methylbutanoic acid (non-preferred name) | | Formula: | C37 H47 N5 O13 S | | SMILES: | O=C(NC1C(OC(C(C1OC(C)=O)OC(C)=O)COC(C)=O)OCCCn2cc(nn2)CN(S(=O)(=O)c3ccc(cc3)c4ccccc4)C(C(C)C)C(=O)O)C | | InChi: | InChI=1S/C37H47N5O13S/c1-22(2)33(36(47)48)42(56(49,50)30-15-13-28(14-16-30)27-11-8-7-9-12-27)20-29-19-41(40-39-29)17-10-18-51-37-32(38-23(3)43)35(54-26(6)46)34(53-25(5)45)31(55-37)21-52-24(4)44/h7-9,11-16,19,22,31-35,37H,10,17-18,20-21H2,1-6H3,(H,38,43)(H,47,48)/t31-,32-,33-,34-,35-,37-/m1/s1 | | Definition date: | 2016-02-12 | | Last modified: | 2016-07-01 | | Release date: | 2016-07-06 | | Identifier: | (2R)-2-[({1-[3-({(2R,3R,4R,5S,6R)-3-(acetylamino)-4,5-bis(acetyloxy)-6-[(acetyloxy)methyl]tetrahydro-2H-pyran-2-yl}oxy)propyl]-1H-1,2,3-triazol-4-yl}methyl)(biphenyl-4-ylsulfonyl)amino]-3-methylbutanoic acid (non-preferred name) |
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 | | 6ON | | Name: | 2-[(9~{S})-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,7,10,12-pentaen-9-yl]-~{N}-[2-[2-[2-[2-[2-[2-[2-[2-[2-[(9~{S})-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,7,10,12-pentaen-9-yl]ethanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]ethanamide | | Formula: | C54 H66 Cl2 N10 O9 S2 | | SMILES: | Cc1sc2n3c(C)nnc3[CH](CC(=O)NCCOCCOCCOCCOCCOCCOCCOCCNC(=O)C[CH]4N=C(c5ccc(Cl)cc5)c6c(C)c(C)sc6n7c(C)nnc47)N=C(c8ccc(Cl)cc8)c2c1C | | InChi: | InChI=1S/C54H66Cl2N10O9S2/c1-33-35(3)76-53-47(33)49(39-7-11-41(55)12-8-39)59-43(51-63-61-37(5)65(51)53)31-45(67)57-15-17-69-19-21-71-23-25-73-27-29-75-30-28-74-26-24-72-22-20-70-18-16-58-46(68)32-44-52-64-62-38(6)66(52)54-48(34(2)36(4)77-54)50(60-44)40-9-13-42(56)14-10-40/h7-14,43-44H,15-32H2,1-6H3,(H,57,67)(H,58,68)/t43-,44-/m0/s1 | | Definition date: | 2016-05-13 | | Last modified: | 2016-07-01 | | Release date: | 2016-07-06 | | Identifier: | 2-[(9~{S})-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,7,10,12-pentaen-9-yl]-~{N}-[2-[2-[2-[2-[2-[2-[2-[2-[2-[(9~{S})-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,7,10,12-pentaen-9-yl]ethanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]ethanamide |
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 | | 4WN | | Name: | 2-[2-(1-methyl-1H-imidazol-2-yl)ethyl]-1,2,3,4-tetrahydroisoquinolin-8-amine | | Formula: | C15 H20 N4 | | SMILES: | C2Cc1cccc(c1CN2CCc3nccn3C)N | | InChi: | InChI=1S/C15H20N4/c1-18-10-7-17-15(18)6-9-19-8-5-12-3-2-4-14(16)13(12)11-19/h2-4,7,10H,5-6,8-9,11,16H2,1H3 | | Definition date: | 2015-06-12 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | 2-[2-(1-methyl-1H-imidazol-2-yl)ethyl]-1,2,3,4-tetrahydroisoquinolin-8-amine |
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 | | 4WT | | Name: | 4,4-dimethyl-1,2,3,4-tetrahydroisoquinoline | | Formula: | C11 H15 N | | SMILES: | C2NCc1ccccc1C2(C)C | | InChi: | InChI=1S/C11H15N/c1-11(2)8-12-7-9-5-3-4-6-10(9)11/h3-6,12H,7-8H2,1-2H3 | | Definition date: | 2015-06-15 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | 4,4-dimethyl-1,2,3,4-tetrahydroisoquinoline |
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 | | 4WU | | Name: | 1,2,3,4-tetrahydroisoquinolin-8-amine | | Formula: | C9 H12 N2 | | SMILES: | C1CNCc2c1cccc2N | | InChi: | InChI=1S/C9H12N2/c10-9-3-1-2-7-4-5-11-6-8(7)9/h1-3,11H,4-6,10H2 | | Definition date: | 2015-06-15 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | 1,2,3,4-tetrahydroisoquinolin-8-amine |
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 | | 4X3 | | Name: | 2-ethyl-1,2,3,4-tetrahydroisoquinolin-5-amine | | Formula: | C11 H16 N2 | | SMILES: | C1N(Cc2c(C1)c(N)ccc2)CC | | InChi: | InChI=1S/C11H16N2/c1-2-13-7-6-10-9(8-13)4-3-5-11(10)12/h3-5H,2,6-8,12H2,1H3 | | Definition date: | 2015-06-16 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | 2-ethyl-1,2,3,4-tetrahydroisoquinolin-5-amine |
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 | | 4X6 | | Name: | 2-methyl-1,2,3,4-tetrahydroisoquinolin-5-amine | | Formula: | C10 H14 N2 | | SMILES: | C1N(Cc2c(C1)c(N)ccc2)C | | InChi: | InChI=1S/C10H14N2/c1-12-6-5-9-8(7-12)3-2-4-10(9)11/h2-4H,5-7,11H2,1H3 | | Definition date: | 2015-06-16 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | 2-methyl-1,2,3,4-tetrahydroisoquinolin-5-amine |
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 | | 4X8 | | Name: | 2-[(4-amino-3-methylpyridin-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-8-amine | | Formula: | C16 H20 N4 | | SMILES: | C1N(Cc2c(C1)cccc2N)Cc3c(c(ccn3)N)C | | InChi: | InChI=1S/C16H20N4/c1-11-14(17)5-7-19-16(11)10-20-8-6-12-3-2-4-15(18)13(12)9-20/h2-5,7H,6,8-10,18H2,1H3,(H2,17,19) | | Definition date: | 2015-06-16 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | 2-[(4-amino-3-methylpyridin-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-8-amine |
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 | | 4XD | | Name: | 2-(2-methoxyethyl)-1,2,3,4-tetrahydroisoquinolin-8-amine | | Formula: | C12 H18 N2 O | | SMILES: | C1N(Cc2c(C1)cccc2N)CCOC | | InChi: | InChI=1S/C12H18N2O/c1-15-8-7-14-6-5-10-3-2-4-12(13)11(10)9-14/h2-4H,5-9,13H2,1H3 | | Definition date: | 2015-06-16 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | 2-(2-methoxyethyl)-1,2,3,4-tetrahydroisoquinolin-8-amine |
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 | | 4XG | | Name: | 2-[3-(dimethylamino)propyl]-1,2,3,4-tetrahydroisoquinolin-8-amine | | Formula: | C14 H23 N3 | | SMILES: | C1N(Cc2c(C1)cccc2N)CCCN(C)C | | InChi: | InChI=1S/C14H23N3/c1-16(2)8-4-9-17-10-7-12-5-3-6-14(15)13(12)11-17/h3,5-6H,4,7-11,15H2,1-2H3 | | Definition date: | 2015-06-17 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | 2-[3-(dimethylamino)propyl]-1,2,3,4-tetrahydroisoquinolin-8-amine |
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 | | 4XJ | | Name: | 2-(1,3-dimethoxypropan-2-yl)-1,2,3,4-tetrahydroisoquinolin-8-amine | | Formula: | C14 H22 N2 O2 | | SMILES: | COCC(N2CCc1cccc(c1C2)N)COC | | InChi: | InChI=1S/C14H22N2O2/c1-17-9-12(10-18-2)16-7-6-11-4-3-5-14(15)13(11)8-16/h3-5,12H,6-10,15H2,1-2H3 | | Definition date: | 2015-06-17 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | 2-(1,3-dimethoxypropan-2-yl)-1,2,3,4-tetrahydroisoquinolin-8-amine |
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 | | 4XK | | Name: | 2-[3-(tetrahydro-2H-pyran-4-yloxy)propyl]-1,2,3,4-tetrahydroisoquinolin-5-amine | | Formula: | C17 H26 N2 O2 | | SMILES: | C1N(Cc2c(C1)c(N)ccc2)CCCOC3CCOCC3 | | InChi: | InChI=1S/C17H26N2O2/c18-17-4-1-3-14-13-19(9-5-16(14)17)8-2-10-21-15-6-11-20-12-7-15/h1,3-4,15H,2,5-13,18H2 | | Definition date: | 2015-06-17 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | 2-[3-(tetrahydro-2H-pyran-4-yloxy)propyl]-1,2,3,4-tetrahydroisoquinolin-5-amine |
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 | | 4XL | | Name: | 2-[3-(morpholin-4-yl)propyl]-1,2,3,4-tetrahydroisoquinolin-8-amine | | Formula: | C16 H25 N3 O | | SMILES: | C1N(Cc2c(C1)cccc2N)CCCN3CCOCC3 | | InChi: | InChI=1S/C16H25N3O/c17-16-4-1-3-14-5-8-19(13-15(14)16)7-2-6-18-9-11-20-12-10-18/h1,3-4H,2,5-13,17H2 | | Definition date: | 2015-06-17 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | 2-[3-(morpholin-4-yl)propyl]-1,2,3,4-tetrahydroisoquinolin-8-amine |
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 | | 4XM | | Name: | 2-[3-(tetrahydro-2H-pyran-4-yloxy)propyl]-1,2,3,4-tetrahydroisoquinolin-8-amine | | Formula: | C17 H26 N2 O2 | | SMILES: | C1N(Cc2c(C1)cccc2N)CCCOC3CCOCC3 | | InChi: | InChI=1S/C17H26N2O2/c18-17-4-1-3-14-5-9-19(13-16(14)17)8-2-10-21-15-6-11-20-12-7-15/h1,3-4,15H,2,5-13,18H2 | | Definition date: | 2015-06-17 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | 2-[3-(tetrahydro-2H-pyran-4-yloxy)propyl]-1,2,3,4-tetrahydroisoquinolin-8-amine |
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 | | 5VN | | Name: | Caulophyllogenin | | Formula: | C30 H48 O5 | | SMILES: | CC1(C)CC[C]2([CH](O)C[C]3(C)C(=CC[CH]4[C]5(C)CC[CH](O)[C](C)(CO)[CH]5CC[C]34C)[CH]2C1)C(O)=O | | InChi: | InChI=1S/C30H48O5/c1-25(2)13-14-30(24(34)35)19(15-25)18-7-8-21-26(3)11-10-22(32)27(4,17-31)20(26)9-12-28(21,5)29(18,6)16-23(30)33/h7,19-23,31-33H,8-17H2,1-6H3,(H,34,35)/t19-,20+,21+,22-,23+,26-,27-,28+,29+,30+/m0/s1 | | Definition date: | 2015-12-09 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | (4~{a}~{R},5~{R},6~{a}~{R},6~{a}~{S},6~{b}~{R},8~{a}~{R},9~{R},10~{S},12~{a}~{R},14~{b}~{S})-9-(hydroxymethyl)-2,2,6~{a},6~{b},9,12~{a}-hexamethyl-5,10-bis(oxidanyl)-1,3,4,5,6,6~{a},7,8,8~{a},10,11,12,13,14~{b}-tetradecahydropicene-4~{a}-carboxylic acid |
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 | | 68N | | Name: | [(1S)-1,2,3,4-tetrahydroisoquinolin-1-yl]methanol | | Formula: | C10 H13 N O | | SMILES: | c1c2c(ccc1)C(NCC2)CO | | InChi: | InChI=1S/C10H13NO/c12-7-10-9-4-2-1-3-8(9)5-6-11-10/h1-4,10-12H,5-7H2/t10-/m1/s1 | | Definition date: | 2016-02-17 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | [(1S)-1,2,3,4-tetrahydroisoquinolin-1-yl]methanol |
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 | | 6BT | | Name: | [(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]methanol | | Formula: | C10 H13 N O | | SMILES: | C1CNC(CO)c2c1cccc2 | | InChi: | InChI=1S/C10H13NO/c12-7-10-9-4-2-1-3-8(9)5-6-11-10/h1-4,10-12H,5-7H2/t10-/m0/s1 | | Definition date: | 2016-03-03 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | [(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]methanol |
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 | | 6K9 | | Name: | (1S,3S,6S,9S,12S,14R,16R,18S,20R,21R,22S,26R,29S,31R,32S,33R,35R,36S)-20-[(2S)-3-amino-2-hydroxypropyl]-21-methoxy-14-methyl-8,15-dimethylidene-2,19,30,34,37,39,40,41-octaoxanonacyclo[24.9.2.1~3,32~.1~3,33~.1~6,9~.1~12,16~.0~18,22~.0~29,36~.0~31,35~]hentetracontan-24-one (non-preferred name) | | Formula: | C40 H59 N O11 | | SMILES: | C31C9OC2C1OC5(C2)OC9C4C(O3)CCC(O4)CC(CC8C(CC7C(/C(CC(CCC6C(CC(CC5)O6)=C)O7)C)=C)OC(C8OC)CC(CN)O)=O | | InChi: | InChI=1S/C40H59NO11/c1-19-11-24-5-7-28-20(2)12-26(45-28)9-10-40-17-33-36(51-40)37-38(50-33)39(52-40)35-29(49-37)8-6-25(47-35)13-22(42)14-27-31(16-30(46-24)21(19)3)48-32(34(27)44-4)15-23(43)18-41/h19,23-39,43H,2-3,5-18,41H2,1,4H3/t19-,23+,24+,25-,26+,27+,28+,29+,30-,31+,32-,33-,34-,35+,36+,37+,38-,39+,40+/m1/s1 | | Definition date: | 2016-04-21 | | Last modified: | 2016-06-24 | | Release date: | 2016-06-29 | | Identifier: | (1S,3S,6S,9S,12S,14R,16R,18S,20R,21R,22S,26R,29S,31R,32S,33R,35R,36S)-20-[(2S)-3-amino-2-hydroxypropyl]-21-methoxy-14-methyl-8,15-dimethylidene-2,19,30,34,37,39,40,41-octaoxanonacyclo[24.9.2.1~3,32~.1~3,33~.1~6,9~.1~12,16~.0~18,22~.0~29,36~.0~31,35~]hentetracontan-24-one (non-preferred name) |
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 | | 4V1 | | Name: | 2-(4-hydroxy-3,5-dimethylphenyl)-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one | | Formula: | C18 H19 N3 O2 S | | SMILES: | N=1c3c(C(NC=1c2cc(C)c(O)c(C)c2)=O)c4c(s3)CN(CC4)C | | InChi: | InChI=1S/C18H19N3O2S/c1-9-6-11(7-10(2)15(9)22)16-19-17(23)14-12-4-5-21(3)8-13(12)24-18(14)20-16/h6-7,22H,4-5,8H2,1-3H3,(H,19,20,23) | | Definition date: | 2015-06-04 | | Last modified: | 2016-06-17 | | Release date: | 2016-06-22 | | Identifier: | 2-(4-hydroxy-3,5-dimethylphenyl)-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one |
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 | | 6CD | | Name: | 2-(tert-butylamino)-3-methyl-8-[(6R)-6-methyl-4-oxo-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrol-2-yl]quinazolin-4(3H)-one | | Formula: | C20 H23 N5 O2 | | SMILES: | CC1c4c(C(N1)=O)cc(c2cccc3C(=O)N(C)C(=Nc23)NC(C)(C)C)n4 | | InChi: | InChI=1S/C20H23N5O2/c1-10-15-13(17(26)21-10)9-14(22-15)11-7-6-8-12-16(11)23-19(24-20(2,3)4)25(5)18(12)27/h6-10,22H,1-5H3,(H,21,26)(H,23,24)/t10-/m1/s1 | | Definition date: | 2016-03-10 | | Last modified: | 2016-06-17 | | Release date: | 2016-06-22 | | Identifier: | 2-(tert-butylamino)-3-methyl-8-[(6R)-6-methyl-4-oxo-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrol-2-yl]quinazolin-4(3H)-one |
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 | | 6EW | | Name: | N-(5-ethyl-3,3-dimethyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzoxazepin-8-yl)-3,4-dimethyl-N-(2,2,2-trifluoroethyl)benzene-1-sulfonamide | | Formula: | C23 H27 F3 N2 O4 S | | SMILES: | O=S(c1ccc(c(c1)C)C)(N(c2ccc3c(c2)OCC(C)(C)C(N3CC)=O)CC(F)(F)F)=O | | InChi: | InChI=1S/C23H27F3N2O4S/c1-6-27-19-10-8-17(12-20(19)32-14-22(4,5)21(27)29)28(13-23(24,25)26)33(30,31)18-9-7-15(2)16(3)11-18/h7-12H,6,13-14H2,1-5H3 | | Definition date: | 2016-03-24 | | Last modified: | 2016-06-10 | | Release date: | 2016-06-15 | | Identifier: | N-(5-ethyl-3,3-dimethyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzoxazepin-8-yl)-3,4-dimethyl-N-(2,2,2-trifluoroethyl)benzene-1-sulfonamide |
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 | | 5EG | | Name: | 2-({5-[(2-chlorophenoxy)methyl]-1H-tetrazol-1-yl}acetyl)-N-(4-chlorophenyl)hydrazinecarboxamide | | Formula: | C17 H15 Cl2 N7 O3 | | SMILES: | C(=O)(Cn1nnnc1COc2ccccc2Cl)NNC(=O)Nc3ccc(cc3)Cl | | InChi: | InChI=1S/C17H15Cl2N7O3/c18-11-5-7-12(8-6-11)20-17(28)23-22-16(27)9-26-15(21-24-25-26)10-29-14-4-2-1-3-13(14)19/h1-8H,9-10H2,(H,22,27)(H2,20,23,28) | | Definition date: | 2015-09-16 | | Last modified: | 2016-06-10 | | Release date: | 2016-06-15 | | Identifier: | 2-({5-[(2-chlorophenoxy)methyl]-1H-tetrazol-1-yl}acetyl)-N-(4-chlorophenyl)hydrazinecarboxamide |
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