N-[6-[4-(2-chlorophenyl)carbonylpiperazin-1-yl]pyridin-3-yl]-2-phenyl-butanamide

Systemtic Name: N-[6-[4-(2-chlorophenyl)carbonylpiperazin-1-yl]pyridin-3-yl]-2-phenyl-butanamide Openeye Name: N-[6-[4-(2-chlorobenzoyl)piperazin-1-yl]-3-pyridyl]-2-phenyl-butanamide CAS Name: N-[6-[4-[(2-chlorophenyl)-oxomethyl]-1-piperazinyl]-3-pyridinyl]-2-phenylbutanamide IUPAC Name: N-[6-[4-(2-chlorobenzoyl)piperazin-1-yl]pyridin-3-yl]-2-phenylbutanamide Traditional Name: N-[6-[4-(2-chlorobenzoyl)piperazino]-3-pyridyl]-2-phenyl-butyramide Formula: C26H27ClN4O2 MolecularWeight: 462.97118

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4Cl

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C26H27ClN4O2/c1-2-21(19-8-4-3-5-9-19)25(32)29-20-12-13-24(28-18-20)30-14-16-31(17-15-30)26(33)22-10-6-7-11-23(22)27/h3-13,18,21H,2,14-17H2,1H3,(H,29,32)