2-(aminomethyl)-N-[4-[[2-(6-azanyl-6-oxidanylidene-hexoxy)-4-methyl-phenyl]-methyl-carbamoyl]-2-methoxy-phenyl]-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-(aminomethyl)-N-[4-[[2-(6-azanyl-6-oxidanylidene-hexoxy)-4-methyl-phenyl]-methyl-carbamoyl]-2-methoxy-phenyl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-(aminomethyl)-N-[4-[[2-(6-amino-6-oxo-hexoxy)-4-methyl-phenyl]-methyl-carbamoyl]-2-methoxy-phenyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-(aminomethyl)-N-[4-[[2-(6-amino-6-oxohexoxy)-N,4-dimethylanilino]-oxomethyl]-2-methoxyphenyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-(aminomethyl)-N-[4-[[2-(6-amino-6-oxohexoxy)-4-methylphenyl]-methylcarbamoyl]-2-methoxyphenyl]-1H-benzimidazole-4-carboxamide Traditional Name: N-[4-[[2-(6-amino-6-keto-hexoxy)-4-methyl-phenyl]-methyl-carbamoyl]-2-methoxy-phenyl]-2-(aminomethyl)-1H-benzimidazole-4-carboxamide Formula: C31H36N6O5 MolecularWeight: 572.65474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)NC(=O)C3=C4C(=CC=C3)NC(=N4)CN)OC)OCCCCCC(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)NC(=O)C3=C4C(=CC=C3)NC(=N4)CN)OC)OCCCCCC(=O)N

InChI

InChI=1S/C31H36N6O5/c1-19-11-14-24(26(16-19)42-15-6-4-5-10-27(33)38)37(2)31(40)20-12-13-22(25(17-20)41-3)35-30(39)21-8-7-9-23-29(21)36-28(18-32)34-23/h7-9,11-14,16-17H,4-6,10,15,18,32H2,1-3H3,(H2,33,38)(H,34,36)(H,35,39)