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

Systemtic Name: (1-methylbenzimidazol-5-yl) N-(2-cyanoethyl)-N-[4-(4-cyanophenyl)-1-phenyl-butan-2-yl]carbamate Openeye Name: (1-methylbenzimidazol-5-yl) N-[1-benzyl-3-(4-cyanophenyl)propyl]-N-(2-cyanoethyl)carbamate CAS Name: N-(2-cyanoethyl)-N-[4-(4-cyanophenyl)-1-phenylbutan-2-yl]carbamic acid (1-methyl-5-benzimidazolyl) ester IUPAC Name: (1-methylbenzimidazol-5-yl) N-(2-cyanoethyl)-N-[4-(4-cyanophenyl)-1-phenylbutan-2-yl]carbamate Traditional Name: N-[1-benzyl-3-(4-cyanophenyl)propyl]-N-(2-cyanoethyl)carbamic acid (1-methylbenzimidazol-5-yl) ester Formula: C29H27N5O2 MolecularWeight: 477.55698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C=CC(=C2)OC(=O)N(CCC#N)C(CCC3=CC=C(C=C3)C#N)CC4=CC=CC=C4

Isomeric SMILES

CN1C=NC2=C1C=CC(=C2)OC(=O)N(CCC#N)C(CCC3=CC=C(C=C3)C#N)CC4=CC=CC=C4

InChI

InChI=1S/C29H27N5O2/c1-33-21-32-27-19-26(14-15-28(27)33)36-29(35)34(17-5-16-30)25(18-23-6-3-2-4-7-23)13-12-22-8-10-24(20-31)11-9-22/h2-4,6-11,14-15,19,21,25H,5,12-13,17-18H2,1H3