N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethanamide Openeye Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-[4-(m-tolyl)piperazin-1-yl]acetamide CAS Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-[4-(3-methylphenyl)-1-piperazinyl]acetamide IUPAC Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide Traditional Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-[4-(m-tolyl)piperazino]acetamide Formula: C24H30N4O MolecularWeight: 390.5212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CC(=O)N(CCC#N)C3=CC(=CC(=C3)C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CC(=O)N(CCC#N)C3=CC(=CC(=C3)C)C

InChI

InChI=1S/C24H30N4O/c1-19-6-4-7-22(15-19)27-12-10-26(11-13-27)18-24(29)28(9-5-8-25)23-16-20(2)14-21(3)17-23/h4,6-7,14-17H,5,9-13,18H2,1-3H3