(1-methylbenzimidazol-5-yl) N-(2-cyanoethyl)-N-[3-(4-cyanophenyl)-1-phenyl-propyl]carbamate

Systemtic Name: (1-methylbenzimidazol-5-yl) N-(2-cyanoethyl)-N-[3-(4-cyanophenyl)-1-phenyl-propyl]carbamate Openeye Name: (1-methylbenzimidazol-5-yl) N-(2-cyanoethyl)-N-[3-(4-cyanophenyl)-1-phenyl-propyl]carbamate CAS Name: N-(2-cyanoethyl)-N-[3-(4-cyanophenyl)-1-phenylpropyl]carbamic acid (1-methyl-5-benzimidazolyl) ester IUPAC Name: (1-methylbenzimidazol-5-yl) N-(2-cyanoethyl)-N-[3-(4-cyanophenyl)-1-phenylpropyl]carbamate Traditional Name: N-(2-cyanoethyl)-N-[3-(4-cyanophenyl)-1-phenyl-propyl]carbamic acid (1-methylbenzimidazol-5-yl) ester Formula: C28H25N5O2 MolecularWeight: 463.5304

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C=CC(=C2)OC(=O)N(CCC#N)C(CCC3=CC=C(C=C3)C#N)C4=CC=CC=C4

Isomeric SMILES

CN1C=NC2=C1C=CC(=C2)OC(=O)N(CCC#N)C(CCC3=CC=C(C=C3)C#N)C4=CC=CC=C4

InChI

InChI=1S/C28H25N5O2/c1-32-20-31-25-18-24(13-15-27(25)32)35-28(34)33(17-5-16-29)26(23-6-3-2-4-7-23)14-12-21-8-10-22(19-30)11-9-21/h2-4,6-11,13,15,18,20,26H,5,12,14,17H2,1H3