| 801 | Name: | 2-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-2-YL}PYRIDIN-3-OLATE | Formula: | C13 H11 N5 O | SMILES: | [O-]c3cccnc3c2nc1cc(ccc1n2)C(=[NH2+])N | InChi: | InChI=1S/C13H11N5O/c14-12(15)7-3-4-8-9(6-7)18-13(17-8)11-10(19)2-1-5-16-11/h1-6,19H,(H3,14,15)(H,17,18) | Synonyms: | CRA_1801 | Definition date: | 2003-03-14 | Last modified: | 2021-03-01 | Identifier: | 2-{5-[amino(iminio)methyl]-1H-benzimidazol-2-yl}pyridin-3-olate |
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| 802 | Name: | 2-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-2-YL}-4-FLUOROBENZENOLATE | Formula: | C14 H11 F N4 O | SMILES: | Fc3cc(c2nc1cc(ccc1n2)C(=[NH2+])N)c([O-])cc3 | InChi: | InChI=1S/C14H11FN4O/c15-8-2-4-12(20)9(6-8)14-18-10-3-1-7(13(16)17)5-11(10)19-14/h1-6,20H,(H3,16,17)(H,18,19) | Synonyms: | CRA_1802 | Definition date: | 2003-03-14 | Last modified: | 2021-03-01 | Identifier: | 2-{5-[amino(iminio)methyl]-1H-benzimidazol-2-yl}-4-fluorophenolate |
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| 950 | Name: | 2-{5-[AMINO(IMINIO)METHYL]-6-FLUORO-1H-BENZIMIDAZOL-2-YL}-6-ISOBUTOXYBENZENOLATE | Formula: | C18 H19 F N4 O2 | SMILES: | [O-]c3c(OCC(C)C)cccc3c2nc1cc(c(F)cc1n2)C(=[NH2+])N | InChi: | InChI=1S/C18H19FN4O2/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_10950 | Definition date: | 2003-03-14 | Last modified: | 2021-03-01 | Identifier: | 2-{5-[amino(iminio)methyl]-6-fluoro-1H-benzimidazol-2-yl}-6-(2-methylpropoxy)phenolate |
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| AAI | Name: | trans-4-(7-carbamoyl-1H-benzimidazol-2-yl)-1-propylpiperidinium | Formula: | C16 H22 N4 O | SMILES: | O=C(N)c1cccc2nc(nc12)C3CCN(CCC)CC3 | InChi: | InChI=1S/C16H22N4O/c1-2-8-20-9-6-11(7-10-20)16-18-13-5-3-4-12(15(17)21)14(13)19-16/h3-5,11H,2,6-10H2,1H3,(H2,17,21)(H,18,19) | Synonyms: | 2-(1-Propyl-piperidin-4-yl)-1H-benzoimidazole-4-carboxylic acid amide | Definition date: | 2007-10-18 | Last modified: | 2021-03-01 | Identifier: | 2-(1-propylpiperidin-4-yl)-1H-benzimidazole-7-carboxamide |
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| XB7 | Name: | 1-[(4-fluorophenyl)methyl]-N-{1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl}-1H-benzimidazol-2-amine | Formula: | C28 H31 F N4 O | SMILES: | COc1ccc(cc1)CCN2CCC(CC2)Nc4n(c3c(cccc3)n4)Cc5ccc(cc5)F | InChi: | InChI=1S/C28H31FN4O/c1-34-25-12-8-21(9-13-25)14-17-32-18-15-24(16-19-32)30-28-31-26-4-2-3-5-27(26)33(28)20-22-6-10-23(29)11-7-22/h2-13,24H,14-20H2,1H3,(H,30,31) | Definition date: | 2020-12-08 | Last modified: | 2021-02-19 | Release date: | 2021-02-24 | Identifier: | 1-[(4-fluorophenyl)methyl]-N-{1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl}-1H-benzimidazol-2-amine |
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| UTS | Name: | 1-benzyl-1H-benzimidazole | Formula: | C14 H12 N2 | SMILES: | c1ccc(cc1)Cn3cnc2ccccc23 | InChi: | InChI=1S/C14H12N2/c1-2-6-12(7-3-1)10-16-11-15-13-8-4-5-9-14(13)16/h1-9,11H,10H2 | Definition date: | 2020-06-02 | Last modified: | 2021-01-08 | Release date: | 2021-01-13 | Identifier: | 1-benzyl-1H-benzimidazole |
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| WRM | Name: | 2-(1H-benzimidazol-1-yl)-N-methylacetamide | Formula: | C10 H11 N3 O | SMILES: | n1(CC(=O)NC)cnc2ccccc12 | InChi: | InChI=1S/C10H11N3O/c1-11-10(14)6-13-7-12-8-4-2-3-5-9(8)13/h2-5,7H,6H2,1H3,(H,11,14) | Definition date: | 2020-11-04 | Last modified: | 2021-01-08 | Release date: | 2021-01-13 | Identifier: | 2-(1H-benzimidazol-1-yl)-N-methylacetamide |
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| W0A | Name: | N-[(1H-benzimidazol-2-yl)methyl]butanamide | Formula: | C12 H15 N3 O | SMILES: | n1c(CNC(=O)CCC)nc2c1cccc2 | InChi: | InChI=1S/C12H15N3O/c1-2-5-12(16)13-8-11-14-9-6-3-4-7-10(9)15-11/h3-4,6-7H,2,5,8H2,1H3,(H,13,16)(H,14,15) | Definition date: | 2020-09-24 | Last modified: | 2021-01-08 | Release date: | 2021-01-13 | Identifier: | N-[(1H-benzimidazol-2-yl)methyl]butanamide |
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| W0D | Name: | N-[(1H-benzimidazol-2-yl)methyl]furan-2-carboxamide | Formula: | C13 H11 N3 O2 | SMILES: | n2c(CNC(=O)c1ccco1)nc3ccccc23 | InChi: | InChI=1S/C13H11N3O2/c17-13(11-6-3-7-18-11)14-8-12-15-9-4-1-2-5-10(9)16-12/h1-7H,8H2,(H,14,17)(H,15,16) | Definition date: | 2020-09-24 | Last modified: | 2021-01-08 | Release date: | 2021-01-13 | Identifier: | N-[(1H-benzimidazol-2-yl)methyl]furan-2-carboxamide |
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| W0V | Name: | N-[(1H-benzimidazol-2-yl)methyl]-2-methylpropanamide | Formula: | C12 H15 N3 O | SMILES: | n1c(CNC(=O)C(C)C)nc2c1cccc2 | InChi: | InChI=1S/C12H15N3O/c1-8(2)12(16)13-7-11-14-9-5-3-4-6-10(9)15-11/h3-6,8H,7H2,1-2H3,(H,13,16)(H,14,15) | Definition date: | 2020-09-24 | Last modified: | 2021-01-08 | Release date: | 2021-01-13 | Identifier: | N-[(1H-benzimidazol-2-yl)methyl]-2-methylpropanamide |
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| D84 | Name: | 5-(1-{[2-(difluoromethoxy)phenyl]methyl}-2-{[3-(2-oxopyrrolidin-1-yl)phenoxy]methyl}-1H-benzimidazol-6-yl)pyridin-2(1H)-one | Formula: | C31 H26 F2 N4 O4 | SMILES: | c1(cc(ccc1)N2CCCC2=O)OCc5n(c4cc(C3=CNC(=O)C=C3)ccc4n5)Cc6c(cccc6)OC(F)F | InChi: | InChI=1S/C31H26F2N4O4/c32-31(33)41-27-8-2-1-5-22(27)18-37-26-15-20(21-11-13-29(38)34-17-21)10-12-25(26)35-28(37)19-40-24-7-3-6-23(16-24)36-14-4-9-30(36)39/h1-3,5-8,10-13,15-17,31H,4,9,14,18-19H2,(H,34,38) | Definition date: | 2017-10-23 | Last modified: | 2021-01-08 | Release date: | 2021-01-13 | Identifier: | 5-(1-{[2-(difluoromethoxy)phenyl]methyl}-2-{[3-(2-oxopyrrolidin-1-yl)phenoxy]methyl}-1H-benzimidazol-6-yl)pyridin-2(1H)-one |
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| WZ6 | Name: | 1-[3-(2-ethoxyethoxy)-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl]-2-(trifluoromethyl)benzimidazole-5-carboxylic acid | Formula: | C27 H31 F3 N2 O4 | SMILES: | CCOCCOc1cc2c(cc1n3c4ccc(cc4nc3C(F)(F)F)C(O)=O)C(C)(C)CCC2(C)C | InChi: | InChI=1S/C27H31F3N2O4/c1-6-35-11-12-36-22-15-18-17(25(2,3)9-10-26(18,4)5)14-21(22)32-20-8-7-16(23(33)34)13-19(20)31-24(32)27(28,29)30/h7-8,13-15H,6,9-12H2,1-5H3,(H,33,34) | Definition date: | 2020-06-30 | Last modified: | 2021-01-01 | Release date: | 2021-01-06 | Identifier: | 1-[3-(2-ethoxyethoxy)-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl]-2-(trifluoromethyl)benzimidazole-5-carboxylic acid |
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| UZG | Name: | 2-[4-(3,4-dimethoxyphenoxy)phenyl]-1H-benzimidazole-6-carboximidamide | Formula: | C22 H20 N4 O3 | SMILES: | COc1c(OC)ccc(c1)Oc2ccc(cc2)c4nc3ccc(cc3n4)C(=N)N | InChi: | InChI=1S/C22H20N4O3/c1-27-19-10-8-16(12-20(19)28-2)29-15-6-3-13(4-7-15)22-25-17-9-5-14(21(23)24)11-18(17)26-22/h3-12H,1-2H3,(H3,23,24)(H,25,26) | Definition date: | 2020-06-08 | Last modified: | 2020-12-25 | Release date: | 2020-12-30 | Identifier: | 2-[4-(3,4-dimethoxyphenoxy)phenyl]-1H-benzimidazole-6-carboximidamide |
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| WBD | Name: | 2,5-dichloro-1H-benzimidazole | Formula: | C7 H4 Cl2 N2 | SMILES: | c21c(nc(Cl)n1)ccc(c2)Cl | InChi: | InChI=1S/C7H4Cl2N2/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H,10,11) | Definition date: | 2020-10-07 | Last modified: | 2020-12-25 | Release date: | 2020-12-30 | Identifier: | 2,5-dichloro-1H-benzimidazole |
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| SZK | Name: | (1-ethyl-1H-benzoimidazol-2-yl)-furan-2-ylmethyl-aminee | Formula: | C14 H15 N3 O | SMILES: | CCn1c(NCc2occc2)nc3ccccc13 | InChi: | InChI=1S/C14H15N3O/c1-2-17-13-8-4-3-7-12(13)16-14(17)15-10-11-6-5-9-18-11/h3-9H,2,10H2,1H3,(H,15,16) | Synonyms: | 1-ethyl-~{N}-(furan-2-ylmethyl)benzimidazol-2-amine | Definition date: | 2020-12-08 | Last modified: | 2020-12-18 | Release date: | 2020-12-23 | Identifier: | 1-ethyl-~{N}-(furan-2-ylmethyl)benzimidazol-2-amine |
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| WZD | Name: | N-[(furan-2-yl)methyl]-1H-benzimidazol-2-amine | Formula: | C12 H11 N3 O | SMILES: | c1cccc2c1nc(n2)NCc3ccco3 | InChi: | InChI=1S/C12H11N3O/c1-2-6-11-10(5-1)14-12(15-11)13-8-9-4-3-7-16-9/h1-7H,8H2,(H2,13,14,15) | Definition date: | 2020-11-18 | Last modified: | 2020-12-18 | Release date: | 2020-12-23 | Identifier: | N-[(furan-2-yl)methyl]-1H-benzimidazol-2-amine |
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| RSN | Name: | (3~{S})-3-azanyl-4-[[(2~{R},3~{S},4~{R},5~{R})-5-[7-azanyl-5-(hydroxymethyl)benzimidazol-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxysulfonylamino]-4-oxidanylidene-butanoic acid | Formula: | C17 H23 N5 O10 S | SMILES: | N[CH](CC(O)=O)C(=O)N[S](=O)(=O)OC[CH]1O[CH]([CH](O)[CH]1O)n2cnc3cc(CO)cc(N)c23 | InChi: | InChI=1S/C17H23N5O10S/c18-8-1-7(4-23)2-10-13(8)22(6-20-10)17-15(27)14(26)11(32-17)5-31-33(29,30)21-16(28)9(19)3-12(24)25/h1-2,6,9,11,14-15,17,23,26-27H,3-5,18-19H2,(H,21,28)(H,24,25)/t9-,11+,14+,15+,17+/m0/s1 | Definition date: | 2020-10-20 | Last modified: | 2020-12-04 | Release date: | 2020-12-09 | Identifier: | (3~{S})-3-azanyl-4-[[(2~{R},3~{S},4~{R},5~{R})-5-[7-azanyl-5-(hydroxymethyl)benzimidazol-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxysulfonylamino]-4-oxidanylidene-butanoic acid |
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| OT1 | Name: | 2-(1-chloranyl-2,3,4,5,6-pentamethyl-1$l^{7}-iridapentacyclo[2.2.0.0^{1,3}.0^{1,5}.0^{2,6}]hexan-1-yl)-1,3-dimethyl-benzimidazole | Formula: | C19 H25 Cl Ir N2 | SMILES: | CC1C(C)C(C)C(C)C1C.Cn2c([Ir]Cl)[n](C)c3ccccc23 | InChi: | InChI=1S/C10H15.C9H10N2.ClH.Ir/c1-6-7(2)9(4)10(5)8(6)3 | Definition date: | 2019-07-03 | Last modified: | 2020-11-20 | Release date: | 2020-11-25 | Identifier: | 2-(1-chloranyl-2,3,4,5,6-pentamethyl-1$l^{7}-iridapentacyclo[2.2.0.0^{1,3}.0^{1,5}.0^{2,6}]hexan-1-yl)-1,3-dimethyl-benzimidazole |
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| R1N | Name: | 2-(1-chloranyl-2,3,4,5,6-pentamethyl-1$l^{7}-rhodapentacyclo[2.2.0.0^{1,3}.0^{1,5}.0^{2,6}]hexan-1-yl)-1,3-dimethyl-benzimidazole | Formula: | C19 H25 Cl N2 Rh | SMILES: | CC1C(C)C(C)C(C)C1C.Cn2c([Rh]Cl)[n](C)c3ccccc23 | InChi: | InChI=1S/C10H15.C9H10N2.ClH.Rh/c1-6-7(2)9(4)10(5)8(6)3 | Definition date: | 2019-07-03 | Last modified: | 2020-11-20 | Release date: | 2020-11-25 | Identifier: | 2-(1-chloranyl-2,3,4,5,6-pentamethyl-1$l^{7}-rhodapentacyclo[2.2.0.0^{1,3}.0^{1,5}.0^{2,6}]hexan-1-yl)-1,3-dimethyl-benzimidazole |
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| WUS | Name: | (5R)-2-methyl-4,5,6,7-tetrahydro-1H-benzimidazol-5-amine | Formula: | C8 H13 N3 | SMILES: | c12CC(CCc1nc(C)n2)N | InChi: | InChI=1S/C8H13N3/c1-5-10-7-3-2-6(9)4-8(7)11-5/h6H,2-4,9H2,1H3,(H,10,11)/t6-/m1/s1 | Definition date: | 2020-11-17 | Last modified: | 2020-11-20 | Release date: | 2020-11-25 | Identifier: | (5R)-2-methyl-4,5,6,7-tetrahydro-1H-benzimidazol-5-amine |
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| O1N | Name: | dichlorido(1,3-dimethylbenzimidazol-2-ylidene)(eta6-p-cymene)osmium(II) | Formula: | C19 H20 Cl2 N2 Os | SMILES: | CC(C)[C]12CC[C](C)(CC1)[Os]2(Cl)(Cl)c3n(C)c4ccccc4[n]3C | InChi: | InChI=1S/C10H14.C9H10N2.2ClH.Os/c1-8(2)10-6-4-9(3)5-7-10 | Definition date: | 2019-07-03 | Last modified: | 2020-11-20 | Release date: | 2020-11-25 |
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| MXH | Name: | 1-~{tert}-butyl-3-[1-[(2~{S})-3-(3-carbamimidoylphenyl)-2-[[3-[3-fluoranyl-4-(hydroxymethyl)phenyl]phenyl]sulfonylamino
]propanoyl]piperidin-4-yl]urea | Formula: | C33 H41 F N6 O5 S | SMILES: | CC(C)(C)NC(=O)NC1CCN(CC1)C(=O)[CH](Cc2cccc(c2)C(N)=N)N[S](=O)(=O)c3cccc(c3)c4ccc(CO)c(F)c4 | InChi: | InChI=1S/C33H41FN6O5S/c1-33(2,3)38-32(43)37-26-12-14-40(15-13-26)31(42)29(17-21-6-4-8-24(16-21)30(35)36)39-46(44,45)27-9-5-7-22(18-27)23-10-11-25(20-41)28(34)19-23/h4-11,16,18-19,26,29,39,41H,12-15,17,20H2,1-3H3,(H3,35,36)(H2,37,38,43)/t29-/m0/s1 | Synonyms: | (S)-3-(3-(4-(3-(tert-butyl)ureido)piperidin-1-yl)-2-((3'-fluoro-4'-(hydroxymethyl)-[1,1'-biphenyl])-3-sulfonamido)-3-ox
opropyl)benzimidamide | Definition date: | 2019-10-29 | Last modified: | 2020-11-13 | Release date: | 2020-11-18 | Identifier: | 1-~{tert}-butyl-3-[1-[(2~{S})-3-(3-carbamimidoylphenyl)-2-[[3-[3-fluoranyl-4-(hydroxymethyl)phenyl]phenyl]sulfonylamino]propanoyl]piperidin-4-yl]urea |
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| WNG | Name: | N-[(Z)-2-phenylethenyl]-1H-benzimidazol-2-amine | Formula: | C15 H13 N3 | SMILES: | c2(nc1c(cccc1)n2)N[C@H]=Cc3ccccc3 | InChi: | InChI=1S/C15H13N3/c1-2-6-12(7-3-1)10-11-16-15-17-13-8-4-5-9-14(13)18-15/h1-11H,(H2,16,17,18)/b11-10- | Definition date: | 2020-10-30 | Last modified: | 2020-11-06 | Release date: | 2020-11-11 | Identifier: | N-[(Z)-2-phenylethenyl]-1H-benzimidazol-2-amine |
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| RUZ | Name: | [(2~{R},3~{S},4~{R},5~{R})-5-[7-azanyl-5-(hydroxymethyl)benzimidazol-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl ~{N}-[(2~{S})-2-azanyl-3-oxidanyl-propanoyl]sulfamate | Formula: | C16 H23 N5 O9 S | SMILES: | N[CH](CO)C(=O)N[S](=O)(=O)OC[CH]1O[CH]([CH](O)[CH]1O)n2cnc3cc(CO)cc(N)c23 | InChi: | InChI=1S/C16H23N5O9S/c17-8-1-7(3-22)2-10-12(8)21(6-19-10)16-14(25)13(24)11(30-16)5-29-31(27,28)20-15(26)9(18)4-23/h1-2,6,9,11,13-14,16,22-25H,3-5,17-18H2,(H,20,26)/t9-,11+,13+,14+,16+/m0/s1 | Synonyms: | SerS7HMDDA | Definition date: | 2020-10-21 | Last modified: | 2020-11-06 | Release date: | 2020-11-11 | Identifier: | [(2~{R},3~{S},4~{R},5~{R})-5-[7-azanyl-5-(hydroxymethyl)benzimidazol-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl ~{N}-[(2~{S})-2-azanyl-3-oxidanyl-propanoyl]sulfamate |
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| RRB | Name: | [(2~{R},3~{S},4~{R},5~{R})-5-[7-azanyl-5-(hydroxymethyl)benzimidazol-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl ~{N}-[(2~{S})-2-azanyl-3-(4-hydroxyphenyl)propanoyl]sulfamate | Formula: | C22 H27 N5 O9 S | SMILES: | N[CH](Cc1ccc(O)cc1)C(=O)N[S](=O)(=O)OC[CH]2O[CH]([CH](O)[CH]2O)n3cnc4cc(CO)cc(N)c34 | InChi: | InChI=1S/C22H27N5O9S/c23-14-6-12(8-28)7-16-18(14)27(10-25-16)22-20(31)19(30)17(36-22)9-35-37(33,34)26-21(32)15(24)5-11-1-3-13(29)4-2-11/h1-4,6-7,10,15,17,19-20,22,28-31H,5,8-9,23-24H2,(H,26,32)/t15-,17+,19+,20+,22+/m0/s1 | Definition date: | 2020-10-20 | Last modified: | 2020-10-23 | Release date: | 2020-10-28 | Identifier: | [(2~{R},3~{S},4~{R},5~{R})-5-[7-azanyl-5-(hydroxymethyl)benzimidazol-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl ~{N}-[(2~{S})-2-azanyl-3-(4-hydroxyphenyl)propanoyl]sulfamate |
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