![BZQ BZQ](https://data.pdbj.org/pdbjplus/data/cc/svg/BZQ.svg) | BZQ | Name: | DIPHENYLMETHANONE | Formula: | C13 H10 O | SMILES: | O=C(c1ccccc1)c2ccccc2 | InChi: | InChI=1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H | Synonyms: | BENZENE, BENZOYL- | Definition date: | 2000-03-08 | Last modified: | 2020-06-17 | Identifier: | diphenylmethanone |
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![C1A C1A](https://data.pdbj.org/pdbjplus/data/cc/svg/C1A.svg) | C1A | Name: | (2,5-dimethylbenzene-1,4-diyl)dimethanediyl bis(N-carbamimidoylcarbamimidothioate) | Formula: | C14 H22 N8 S2 | SMILES: | S(C(=[N@H])NC(=[N@H])N)Cc1cc(c(cc1C)CSC(=[N@H])NC(=[N@H])N)C | InChi: | InChI=1S/C14H22N8S2/c1-7-3-10(6-24-14(20)22-12(17)18)8(2)4-9(7)5-23-13(19)21-11(15)16/h3-4H,5-6H2,1-2H3,(H5,15,16,19,21)(H5,17,18,20,22) | Synonyms: | 4-({[(E)-{[(E)-AMINO(IMINO)METHYL]AMINO}(IMINO)METHYL]SULFANYL}METHYL)-2,5-DIMETHYLBENZYL
N-[(E)-AMINO(IMINO)METHYL]IMIDOTHIOCARBAMATE | Definition date: | 2005-08-31 | Last modified: | 2020-06-17 | Identifier: | (2,5-dimethylbenzene-1,4-diyl)dimethanediyl bis(N-carbamimidoylcarbamimidothioate) |
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![C8X C8X](https://data.pdbj.org/pdbjplus/data/cc/svg/C8X.svg) | C8X | Name: | bis(2-hydroxyethyl) benzene-1,4-dicarboxylate | Formula: | C12 H14 O6 | SMILES: | OCCOC(=O)c1ccc(cc1)C(=O)OCCO | InChi: | InChI=1S/C12H14O6/c13-5-7-17-11(15)9-1-2-10(4-3-9)12(16)18-8-6-14/h1-4,13-14H,5-8H2 | Synonyms: | bis(2-hydroxyethyl) terephthalate | Definition date: | 2019-04-16 | Last modified: | 2020-06-17 | Release date: | 2020-04-15 | Identifier: | bis(2-hydroxyethyl) benzene-1,4-dicarboxylate |
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![3BS 3BS](https://data.pdbj.org/pdbjplus/data/cc/svg/3BS.svg) | 3BS | Name: | 3-chloro-4-{[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)carbamothioyl]amino}benzenesulfonamide | Formula: | C16 H25 Cl N4 O3 S2 | SMILES: | O=S(=O)(N)c1ccc(c(Cl)c1)NC(=S)NC2CC(N(O)C(C)(C)C2)(C)C | InChi: | InChI=1S/C16H25ClN4O3S2/c1-15(2)8-10(9-16(3,4)21(15)22)19-14(25)20-13-6-5-11(7-12(13)17)26(18,23)24/h5-7,10,22H,8-9H2,1-4H3,(H2,18,23,24)(H2,19,20,25) | Synonyms: | (4-{[(2-chloro-4-sulfamoylphenyl)carbamothioyl]amino}-2,2,6,6-tetramethylpiperidin-1-yl)oxidanyl | Definition date: | 2008-09-12 | Last modified: | 2020-06-17 | Identifier: | 3-chloro-4-{[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)carbamothioyl]amino}benzenesulfonamide |
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![3BT 3BT](https://data.pdbj.org/pdbjplus/data/cc/svg/3BT.svg) | 3BT | Name: | 2-{2-[3-(2-CARBAMIMIDOYLSULFANYL-ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA | Formula: | C12 H18 N4 S2 | SMILES: | S(C(=[N@H])N)CCc1cccc(c1)CCSC(=[N@H])N | InChi: | InChI=1S/C12H18N4S2/c13-11(14)17-6-4-9-2-1-3-10(8-9)5-7-18-12(15)16/h1-3,8H,4-7H2,(H3,13,14)(H3,15,16) | Synonyms: | S,S'-(1,3-PHENYLENE-BIS(1,2-ETHANEDIYL))BIS-ISOTHIOUREA | Definition date: | 1999-09-23 | Last modified: | 2020-06-17 | Identifier: | benzene-1,3-diyldiethane-2,1-diyl bis(imidothiocarbamate) |
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![3F1 3F1](https://data.pdbj.org/pdbjplus/data/cc/svg/3F1.svg) | 3F1 | Name: | N-{[4-(benzyloxy)phenyl](methyl)-lambda~4~-sulfanylidene}-4-methylbenzenesulfonamide | Formula: | C21 H21 N O3 S2 | SMILES: | Cc1ccc(cc1)[S](=O)(=O)N=[S](C)c2ccc(OCc3ccccc3)cc2 | InChi: | InChI=1S/C21H21NO3S2/c1-17-8-14-21(15-9-17)27(23,24)22-26(2)20-12-10-19(11-13-20)25-16-18-6-4-3-5-7-18/h3-15H,16H2,1-2H3/t26-/m1/s1 | Synonyms: | N-{[4-(benzyloxy)phenyl](methyl)-lambda}-4-methylbenzenesulfonamide | Definition date: | 2010-01-18 | Last modified: | 2020-06-17 | Identifier: | 4-methyl-N-[(R)-methyl-(4-phenylmethoxyphenyl)-$l^{4}-sulfanylidene]benzenesulfonamide |
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![3GY 3GY](https://data.pdbj.org/pdbjplus/data/cc/svg/3GY.svg) | 3GY | Name: | (2R)-butan-2-ylbenzene | Formula: | C10 H14 | SMILES: | c1ccccc1C(CC)C | InChi: | InChI=1S/C10H14/c1-3-9(2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3/t9-/m1/s1 | Synonyms: | sec-Butylbenzene | Definition date: | 2014-08-18 | Last modified: | 2020-06-17 | Release date: | 2015-04-01 | Identifier: | (2R)-butan-2-ylbenzene |
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![3JL 3JL](https://data.pdbj.org/pdbjplus/data/cc/svg/3JL.svg) | 3JL | Name: | 3-(3-carboxypropyl)benzene-1,2-dicarboxylic acid | Formula: | C12 H12 O6 | SMILES: | O=C(O)c1cccc(c1C(=O)O)CCCC(=O)O | InChi: | InChI=1S/C12H12O6/c13-9(14)6-2-4-7-3-1-5-8(11(15)16)10(7)12(17)18/h1,3,5H,2,4,6H2,(H,13,14)(H,15,16)(H,17,18) | Synonyms: | 3-carboxypropyl-phthalic acid | Definition date: | 2014-08-27 | Last modified: | 2020-06-17 | Release date: | 2014-12-10 | Identifier: | 3-(3-carboxypropyl)benzene-1,2-dicarboxylic acid |
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![3JM 3JM](https://data.pdbj.org/pdbjplus/data/cc/svg/3JM.svg) | 3JM | Name: | 3-(2-carboxyethyl)benzene-1,2-dicarboxylic acid | Formula: | C11 H10 O6 | SMILES: | O=C(O)c1cccc(c1C(=O)O)CCC(=O)O | InChi: | InChI=1S/C11H10O6/c12-8(13)5-4-6-2-1-3-7(10(14)15)9(6)11(16)17/h1-3H,4-5H2,(H,12,13)(H,14,15)(H,16,17) | Synonyms: | 3-carboxy-ethyl-phthalic acid | Definition date: | 2014-08-27 | Last modified: | 2020-06-17 | Release date: | 2014-12-10 | Identifier: | 3-(2-carboxyethyl)benzene-1,2-dicarboxylic acid |
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![42T 42T](https://data.pdbj.org/pdbjplus/data/cc/svg/42T.svg) | 42T | Name: | 3-{[(2,6-dichlorophenyl)carbamoyl]amino}-N-hydroxy-N'-phenyl-5-(trifluoromethyl)benzenecarboximidamide | Formula: | C21 H15 Cl2 F3 N4 O2 | SMILES: | Clc3cccc(Cl)c3NC(=O)Nc2cc(C(=Nc1ccccc1)/NO)cc(c2)C(F)(F)F | InChi: | InChI=1S/C21H15Cl2F3N4O2/c22-16-7-4-8-17(23)18(16)29-20(31)28-15-10-12(9-13(11-15)21(24,25)26)19(30-32)27-14-5-2-1-3-6-14/h1-11,32H,(H,27,30)(H2,28,29,31) | Synonyms: | CBR-9379 | Definition date: | 2015-01-23 | Last modified: | 2020-06-17 | Release date: | 2015-07-22 | Identifier: | 3-{[(2,6-dichlorophenyl)carbamoyl]amino}-N-hydroxy-N'-phenyl-5-(trifluoromethyl)benzenecarboximidamide |
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![478 478](https://data.pdbj.org/pdbjplus/data/cc/svg/478.svg) | 478 | Name: | {3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YL ESTER | Formula: | C25 H35 N3 O6 S | SMILES: | O=C(OC1CCOC1)NC(Cc2ccccc2)C(O)CN(CC(C)C)S(=O)(=O)c3ccc(N)cc3 | InChi: | InChI=1S/C25H35N3O6S/c1-18(2)15-28(35(31,32)22-10-8-20(26)9-11-22)16-24(29)23(14-19-6-4-3-5-7-19)27-25(30)34-21-12-13-33-17-21/h3-11,18,21,23-24,29H,12-17,26H2,1-2H3,(H,27,30)/t21-,23-,24+/m0/s1 | Synonyms: | Amprenavir | Definition date: | 1999-07-08 | Last modified: | 2020-06-17 | Identifier: | (3S)-tetrahydrofuran-3-yl [(2S,3R)-4-{[(4-aminophenyl)sulfonyl](2-methylpropyl)amino}-3-hydroxy-1-phenylbutan-2-yl]carbamate |
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![4BT 4BT](https://data.pdbj.org/pdbjplus/data/cc/svg/4BT.svg) | 4BT | Name: | 2-{2-[4-(2-CARBAMIMIDOYLSULFANYL-ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA | Formula: | C12 H18 N4 S2 | SMILES: | S(C(=[N@H])N)CCc1ccc(cc1)CCSC(=[N@H])N | InChi: | InChI=1S/C12H18N4S2/c13-11(14)17-7-5-9-1-2-10(4-3-9)6-8-18-12(15)16/h1-4H,5-8H2,(H3,13,14)(H3,15,16) | Synonyms: | S,S'-(1,4-PHENYLENE-BIS(1,2-ETHANEDIYL))BIS-ISOTHIOUREA | Definition date: | 1999-09-23 | Last modified: | 2020-06-17 | Identifier: | benzene-1,4-diyldiethane-2,1-diyl bis(imidothiocarbamate) |
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![6Q1 6Q1](https://data.pdbj.org/pdbjplus/data/cc/svg/6Q1.svg) | 6Q1 | Name: | 15-{4-[(4-methylpiperazin-1-yl)methyl]phenyl}-4,5,6,7,9,10,11,12-octahydro-2,16-(azenometheno)pyrrolo[2,1-d][1,3,5,9]te
traazacyclotetradecin-8(3H)-one | Formula: | C26 H35 N7 O | SMILES: | c1cc(ccc1CN2CCN(C)CC2)c3cn4c5c3cnc(NCCCCC(NCCC4)=O)n5 | InChi: | InChI=1S/C26H35N7O/c1-31-13-15-32(16-14-31)18-20-6-8-21(9-7-20)23-19-33-12-4-11-27-24(34)5-2-3-10-28-26-29-17-22(23)25(33)30-26/h6-9,17,19H,2-5,10-16,18H2,1H3,(H,27,34)(H,28,29,30) | Synonyms: | UNC2434 | Definition date: | 2016-05-19 | Last modified: | 2020-06-17 | Release date: | 2017-01-11 | Identifier: | 15-{4-[(4-methylpiperazin-1-yl)methyl]phenyl}-4,5,6,7,9,10,11,12-octahydro-2,16-(azenometheno)pyrrolo[2,1-d][1,3,5,9]tetraazacyclotetradecin-8(3H)-one |
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![6RL 6RL](https://data.pdbj.org/pdbjplus/data/cc/svg/6RL.svg) | 6RL | Name: | 2-[[6-[(3~{R})-3-azanylpiperidin-1-yl]-3-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]-4-fluoranyl-benzenecarboni
trile | Formula: | C18 H20 F N5 O2 | SMILES: | CN1C(=O)C=C(N2CCC[CH](N)C2)N(Cc3cc(F)ccc3C#N)C1=O | InChi: | InChI=1S/C18H20FN5O2/c1-22-17(25)8-16(23-6-2-3-15(21)11-23)24(18(22)26)10-13-7-14(19)5-4-12(13)9-20/h4-5,7-8,15H,2-3,6,10-11,21H2,1H3/t15-/m1/s1 | Synonyms: | SYR-472 | Definition date: | 2016-06-06 | Last modified: | 2020-06-17 | Release date: | 2016-07-13 | Identifier: | 2-[[6-[(3~{R})-3-azanylpiperidin-1-yl]-3-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]-4-fluoranyl-benzenecarbonitrile |
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![972 972](https://data.pdbj.org/pdbjplus/data/cc/svg/972.svg) | 972 | Name: | 2-{5-[AMINO(IMINIO)METHYL]-6-CHLORO-1H-BENZIMIDAZOL-2-YL}-6-ISOBUTOXYBENZENOLATE | Formula: | C18 H19 Cl N4 O2 | SMILES: | [O-]c3c(OCC(C)C)cccc3c2nc1cc(c(Cl)cc1n2)C(=[NH2+])N | InChi: | InChI=1S/C18H19ClN4O2/c1-9(2)8-25-15-5-3-4-10(16(15)24)18-22-13-6-11(17(20)21)12(19)7-14(13)23-18/h3-7,9,24H,8H2,1-2H3,(H3,20,21)(H,22,23) | Synonyms: | CRA_10972 | Definition date: | 2003-03-14 | Last modified: | 2020-06-17 | Identifier: | 2-{5-[amino(iminio)methyl]-6-chloro-1H-benzimidazol-2-yl}-6-(2-methylpropoxy)phenolate |
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![9KL 9KL](https://data.pdbj.org/pdbjplus/data/cc/svg/9KL.svg) | 9KL | Name: | (2S)-2-[3-(benzenecarbonyl)phenyl]propanoic acid | Formula: | C16 H14 O3 | SMILES: | c1cc(C(C)C(=O)O)cc(c1)C(=O)c2ccccc2 | InChi: | InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)/t11-/m0/s1 | Synonyms: | Dexketoprofen | Definition date: | 2018-05-21 | Last modified: | 2020-06-17 | Release date: | 2019-03-13 | Identifier: | (2S)-2-[3-(benzenecarbonyl)phenyl]propanoic acid |
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![EF6 EF6](https://data.pdbj.org/pdbjplus/data/cc/svg/EF6.svg) | EF6 | Name: | N~1~-(3-chloro-1H-indol-7-yl)benzene-1,4-disulfonamide | Formula: | C14 H12 Cl N3 O4 S2 | SMILES: | N(S(=O)(c1ccc(cc1)S(N)(=O)=O)=O)c2cccc3c2ncc3Cl | InChi: | InChI=1S/C14H12ClN3O4S2/c15-12-8-17-14-11(12)2-1-3-13(14)18-24(21,22)10-6-4-9(5-7-10)23(16,19)20/h1-8,17-18H,(H2,16,19,20) | Synonyms: | Indisulam | Definition date: | 2019-08-05 | Last modified: | 2020-06-17 | Release date: | 2019-11-13 | Identifier: | N~1~-(3-chloro-1H-indol-7-yl)benzene-1,4-disulfonamide |
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![24B 24B](https://data.pdbj.org/pdbjplus/data/cc/svg/24B.svg) | 24B | Name: | (2,4-DIFLUOROPHENYL)METHANOL | Formula: | C7 H6 F2 O | SMILES: | Fc1cc(F)ccc1CO | InChi: | InChI=1S/C7H6F2O/c8-6-2-1-5(4-10)7(9)3-6/h1-3,10H,4H2 | Synonyms: | 2,4-DIFLUOROBENZYL ALCOHOL 2,4-DIFLUORO-1-(HYDROXYMETHYL)BENZENE | Definition date: | 2003-09-11 | Last modified: | 2020-06-17 | Identifier: | (2,4-difluorophenyl)methanol |
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![BPF BPF](https://data.pdbj.org/pdbjplus/data/cc/svg/BPF.svg) | BPF | Name: | N,N'-(furan-2,5-diylbis{benzene-4,1-diyl[(Z)-aminomethylylidene]})diethanaminium | Formula: | C22 H26 N4 O | SMILES: | o1c(ccc1c2ccc(/C(=[NH+]/CC)N)cc2)c3ccc(C(=[NH+]/CC)/N)cc3 | InChi: | InChI=1S/C22H24N4O/c1-3-25-21(23)17-9-5-15(6-10-17)19-13-14-20(27-19)16-7-11-18(12-8-16)22(24)26-4-2/h5-14H,3-4H2,1-2H3,(H2,23,25)(H2,24,26)/p+2 | Synonyms: | DB185 | Definition date: | 1999-07-08 | Last modified: | 2020-06-17 | Identifier: | N,N'-(furan-2,5-diylbis{benzene-4,1-diyl[(Z)-aminomethylylidene]})diethanaminium |
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![BPS BPS](https://data.pdbj.org/pdbjplus/data/cc/svg/BPS.svg) | BPS | Name: | 1,1'-BIPHENYL-2-SULFINIC ACID | Formula: | C12 H10 O2 S | SMILES: | O=S(O)c2ccccc2c1ccccc1 | InChi: | InChI=1S/C12H10O2S/c13-15(14)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H,(H,13,14) | Synonyms: | BIPHENYL-2-SULFINIC ACID | Definition date: | 2004-10-15 | Last modified: | 2020-06-17 | Identifier: | biphenyl-2-sulfinic acid |
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![BRE BRE](https://data.pdbj.org/pdbjplus/data/cc/svg/BRE.svg) | BRE | Name: | 2-BIPHENYL-4-YL-6-FLUORO-3-METHYL-QUINOLINE-4-CARBOXYLIC ACID | Formula: | C23 H16 F N O2 | SMILES: | Fc1ccc2nc(c(c(c2c1)C(=O)O)C)c4ccc(c3ccccc3)cc4 | InChi: | InChI=1S/C23H16FNO2/c1-14-21(23(26)27)19-13-18(24)11-12-20(19)25-22(14)17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-13H,1H3,(H,26,27) | Synonyms: | BREQUINAR ANALOG | Definition date: | 1999-10-01 | Last modified: | 2020-06-17 | Identifier: | 2-biphenyl-4-yl-6-fluoro-3-methylquinoline-4-carboxylic acid |
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![BRN BRN](https://data.pdbj.org/pdbjplus/data/cc/svg/BRN.svg) | BRN | Name: | BERENIL | Formula: | C14 H15 N7 | SMILES: | N(=N/Nc1ccc(cc1)C(=[N@H])N)c2ccc(C(=[N@H])N)cc2 | InChi: | InChI=1S/C14H15N7/c15-13(16)9-1-5-11(6-2-9)19-21-20-12-7-3-10(4-8-12)14(17)18/h1-8H,(H3,15,16)(H3,17,18)(H,19,20) | Synonyms: | DIMINAZINE ACETURATE | Definition date: | 1999-07-08 | Last modified: | 2020-06-17 | Identifier: | 4-[(1E)-3-(4-carbamimidoylphenyl)triaz-1-en-1-yl]benzenecarboximidamide |
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![BRV BRV](https://data.pdbj.org/pdbjplus/data/cc/svg/BRV.svg) | BRV | Name: | 5-amino-2,4,6-tribromobenzene-1,3-dicarboxylic acid | Formula: | C8 H4 Br3 N O4 | SMILES: | Brc1c(c(Br)c(C(=O)O)c(Br)c1N)C(=O)O | InChi: | InChI=1S/C8H4Br3NO4/c9-3-1(7(13)14)4(10)6(12)5(11)2(3)8(15)16/h12H2,(H,13,14)(H,15,16) | Synonyms: | 5-Amino-2,4,6-tribromoisophthalic acid | Definition date: | 2009-03-30 | Last modified: | 2020-06-17 | Identifier: | 5-amino-2,4,6-tribromobenzene-1,3-dicarboxylic acid |
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![F9F F9F](https://data.pdbj.org/pdbjplus/data/cc/svg/F9F.svg) | F9F | Name: | 2-({[4-(TRIFLUOROMETHOXY)PHENYL]SULFONYL}AMINO)ETHYL DIHYDROGEN PHOSPHATE | Formula: | C9 H11 F3 N O7 P S | SMILES: | FC(F)(F)Oc1ccc(cc1)S(=O)(=O)NCCOP(=O)(O)O | InChi: | InChI=1S/C9H11F3NO7PS/c10-9(11,12)20-7-1-3-8(4-2-7)22(17,18)13-5-6-19-21(14,15)16/h1-4,13H,5-6H2,(H2,14,15,16) | Synonyms: | N-(4'-TRIFLUOROMETHOXYBENZENESULFONYL)-2-AMINO-1-ETHYLPHOSPHATE, F9 | Definition date: | 2004-08-04 | Last modified: | 2020-06-17 | Identifier: | 2-({[4-(trifluoromethoxy)phenyl]sulfonyl}amino)ethyl dihydrogen phosphate |
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![8VY 8VY](https://data.pdbj.org/pdbjplus/data/cc/svg/8VY.svg) | 8VY | Name: | 1,3-bis(bromomethyl)benzene | Formula: | C8 H8 Br2 | SMILES: | BrCc1cccc(CBr)c1 | InChi: | InChI=1S/C8H8Br2/c9-5-7-2-1-3-8(4-7)6-10/h1-4H,5-6H2 | Synonyms: | alpha,alpha'-dibromo-m-xylene | Definition date: | 2017-03-08 | Last modified: | 2020-06-17 | Release date: | 2017-07-19 | Identifier: | 1,3-bis(bromomethyl)benzene |
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