4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(4-cyanophenyl)-4-oxidanylidene-butanamide

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(4-cyanophenyl)-4-oxidanylidene-butanamide Openeye Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(4-cyanophenyl)-4-oxo-butanamide CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-N-(4-cyanophenyl)-4-oxobutanamide IUPAC Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(4-cyanophenyl)-4-oxobutanamide Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-N-(4-cyanophenyl)-4-keto-butyramide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCC(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCC(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H21ClN4O2/c22-17-2-1-3-19(14-17)25-10-12-26(13-11-25)21(28)9-8-20(27)24-18-6-4-16(15-23)5-7-18/h1-7,14H,8-13H2,(H,24,27)