N-[4-[4-(3-chlorophenyl)piperazin-1-yl]carbonylphenyl]-2-cyano-ethanamide

Systemtic Name: N-[4-[4-(3-chlorophenyl)piperazin-1-yl]carbonylphenyl]-2-cyano-ethanamide Openeye Name: N-[4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl]-2-cyano-acetamide CAS Name: N-[4-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]phenyl]-2-cyanoacetamide IUPAC Name: N-[4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl]-2-cyanoacetamide Traditional Name: N-[4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl]-2-cyano-acetamide Formula: C20H19ClN4O2 MolecularWeight: 382.84346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN4O2/c21-16-2-1-3-18(14-16)24-10-12-25(13-11-24)20(27)15-4-6-17(7-5-15)23-19(26)8-9-22/h1-7,14H,8,10-13H2,(H,23,26)