ethyl 1-[(2,4-dichlorophenyl)methyl]-2-[4-[N'-[(3,4-dichlorophenyl)methyl]carbamimidoyl]phenyl]benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-[(2,4-dichlorophenyl)methyl]-2-[4-[N'-[(3,4-dichlorophenyl)methyl]carbamimidoyl]phenyl]benzimidazole-5-carboxylate Openeye Name: ethyl 1-[(2,4-dichlorophenyl)methyl]-2-[4-[N'-[(3,4-dichlorophenyl)methyl]carbamimidoyl]phenyl]benzimidazole-5-carboxylate CAS Name: 2-[4-[amino-[(3,4-dichlorophenyl)methylimino]methyl]phenyl]-1-[(2,4-dichlorophenyl)methyl]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2,4-dichlorophenyl)methyl]-2-[4-[N'-[(3,4-dichlorophenyl)methyl]carbamimidoyl]phenyl]benzimidazole-5-carboxylate Traditional Name: 1-(2,4-dichlorobenzyl)-2-[4-[N'-(3,4-dichlorobenzyl)amidino]phenyl]benzimidazole-5-carboxylic acid ethyl ester Formula: C31H24Cl4N4O2 MolecularWeight: 626.35986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)C(=NCC4=CC(=C(C=C4)Cl)Cl)N)CC5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)C(=NCC4=CC(=C(C=C4)Cl)Cl)N)CC5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C31H24Cl4N4O2/c1-2-41-31(40)21-9-12-28-27(14-21)38-30(39(28)17-22-8-10-23(32)15-25(22)34)20-6-4-19(5-7-20)29(36)37-16-18-3-11-24(33)26(35)13-18/h3-15H,2,16-17H2,1H3,(H2,36,37)