1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(phenylmethylsulfanyl)propan-1-one

Systemtic Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(phenylmethylsulfanyl)propan-1-one Openeye Name: 3-benzylsulfanyl-1-[4-(3-chlorophenyl)piperazin-1-yl]propan-1-one CAS Name: 1-[4-(3-chlorophenyl)-1-piperazinyl]-3-(phenylmethylthio)-1-propanone IUPAC Name: 3-benzylsulfanyl-1-[4-(3-chlorophenyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(benzylthio)-1-[4-(3-chlorophenyl)piperazino]propan-1-one Formula: C20H23ClN2OS MolecularWeight: 374.92742

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCSCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCSCC3=CC=CC=C3

InChI

InChI=1S/C20H23ClN2OS/c21-18-7-4-8-19(15-18)22-10-12-23(13-11-22)20(24)9-14-25-16-17-5-2-1-3-6-17/h1-8,15H,9-14,16H2