N-(3-chloranyl-4-cyano-phenyl)-2-[4-(phenylmethyl)piperazin-1-yl]propanamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-2-[4-(phenylmethyl)piperazin-1-yl]propanamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-(3-chloro-4-cyano-phenyl)propanamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-[4-(phenylmethyl)-1-piperazinyl]propanamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-(3-chloro-4-cyanophenyl)propanamide Traditional Name: 2-(4-benzylpiperazino)-N-(3-chloro-4-cyano-phenyl)propionamide Formula: C21H23ClN4O MolecularWeight: 382.88652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)C#N)Cl)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)C#N)Cl)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H23ClN4O/c1-16(21(27)24-19-8-7-18(14-23)20(22)13-19)26-11-9-25(10-12-26)15-17-5-3-2-4-6-17/h2-8,13,16H,9-12,15H2,1H3,(H,24,27)