[4-[(4-chlorophenyl)sulfanylmethyl]phenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [4-[(4-chlorophenyl)sulfanylmethyl]phenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Openeye Name: [4-[(4-chlorophenyl)sulfanylmethyl]phenyl]-[4-(2-pyridyl)piperazin-1-yl]methanone CAS Name: [4-[[(4-chlorophenyl)thio]methyl]phenyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone IUPAC Name: [4-[(4-chlorophenyl)sulfanylmethyl]phenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Traditional Name: [4-[[(4-chlorophenyl)thio]methyl]phenyl]-[4-(2-pyridyl)piperazino]methanone Formula: C23H22ClN3OS MolecularWeight: 423.95828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=CC=C(C=C3)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=CC=C(C=C3)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H22ClN3OS/c24-20-8-10-21(11-9-20)29-17-18-4-6-19(7-5-18)23(28)27-15-13-26(14-16-27)22-3-1-2-12-25-22/h1-12H,13-17H2