N-(2-cyanoethyl)-2-[2-(4-cyanophenyl)ethyl]-1-methyl-N-(phenylmethyl)benzimidazole-5-carboxamide

Systemtic Name: N-(2-cyanoethyl)-2-[2-(4-cyanophenyl)ethyl]-1-methyl-N-(phenylmethyl)benzimidazole-5-carboxamide Openeye Name: N-benzyl-N-(2-cyanoethyl)-2-[2-(4-cyanophenyl)ethyl]-1-methyl-benzimidazole-5-carboxamide CAS Name: N-(2-cyanoethyl)-2-[2-(4-cyanophenyl)ethyl]-1-methyl-N-(phenylmethyl)-5-benzimidazolecarboxamide IUPAC Name: N-benzyl-N-(2-cyanoethyl)-2-[2-(4-cyanophenyl)ethyl]-1-methylbenzimidazole-5-carboxamide Traditional Name: N-benzyl-N-(2-cyanoethyl)-2-[2-(4-cyanophenyl)ethyl]-1-methyl-benzimidazole-5-carboxamide Formula: C28H25N5O MolecularWeight: 447.531

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)N(CCC#N)CC3=CC=CC=C3)N=C1CCC4=CC=C(C=C4)C#N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)N(CCC#N)CC3=CC=CC=C3)N=C1CCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C28H25N5O/c1-32-26-14-13-24(28(34)33(17-5-16-29)20-23-6-3-2-4-7-23)18-25(26)31-27(32)15-12-21-8-10-22(19-30)11-9-21/h2-4,6-11,13-14,18H,5,12,15,17,20H2,1H3