2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(2-cyanoethyl)-N-phenyl-ethanamide

Systemtic Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(2-cyanoethyl)-N-phenyl-ethanamide Openeye Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(2-cyanoethyl)-N-phenyl-acetamide CAS Name: 2-[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-N-(2-cyanoethyl)-N-phenylacetamide IUPAC Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(2-cyanoethyl)-N-phenylacetamide Traditional Name: 2-[4-(3-chlorobenzyl)piperazino]-N-(2-cyanoethyl)-N-phenyl-acetamide Formula: C22H25ClN4O MolecularWeight: 396.9131

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)Cl)CC(=O)N(CCC#N)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)Cl)CC(=O)N(CCC#N)C3=CC=CC=C3

InChI

InChI=1S/C22H25ClN4O/c23-20-7-4-6-19(16-20)17-25-12-14-26(15-13-25)18-22(28)27(11-5-10-24)21-8-2-1-3-9-21/h1-4,6-9,16H,5,11-15,17-18H2