6-(2-methoxyethanoylamino)-N-[(3-methylphenyl)methyl]-3-phenethyl-benzimidazole-4-carboxamide

Systemtic Name: 6-(2-methoxyethanoylamino)-N-[(3-methylphenyl)methyl]-3-phenethyl-benzimidazole-4-carboxamide Openeye Name: 6-[(2-methoxyacetyl)amino]-N-(m-tolylmethyl)-3-phenethyl-benzimidazole-4-carboxamide CAS Name: 6-[(2-methoxy-1-oxoethyl)amino]-N-[(3-methylphenyl)methyl]-3-phenethyl-4-benzimidazolecarboxamide IUPAC Name: 6-[(2-methoxyacetyl)amino]-N-[(3-methylphenyl)methyl]-3-phenethylbenzimidazole-4-carboxamide Traditional Name: 6-[(2-methoxyacetyl)amino]-N-(3-methylbenzyl)-3-phenethyl-benzimidazole-4-carboxamide Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2=CC(=CC3=C2N(C=N3)CCC4=CC=CC=C4)NC(=O)COC

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2=CC(=CC3=C2N(C=N3)CCC4=CC=CC=C4)NC(=O)COC

InChI

InChI=1S/C27H28N4O3/c1-19-7-6-10-21(13-19)16-28-27(33)23-14-22(30-25(32)17-34-2)15-24-26(23)31(18-29-24)12-11-20-8-4-3-5-9-20/h3-10,13-15,18H,11-12,16-17H2,1-2H3,(H,28,33)(H,30,32)