1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(phenylmethylsulfanyl)ethanone

Systemtic Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(phenylmethylsulfanyl)ethanone Openeye Name: 2-benzylsulfanyl-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanone CAS Name: 1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-(phenylmethylthio)ethanone IUPAC Name: 2-benzylsulfanyl-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanone Traditional Name: 2-(benzylthio)-1-[4-(2,3-dimethylphenyl)piperazino]ethanone Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CSCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CSCC3=CC=CC=C3)C

InChI

InChI=1S/C21H26N2OS/c1-17-7-6-10-20(18(17)2)22-11-13-23(14-12-22)21(24)16-25-15-19-8-4-3-5-9-19/h3-10H,11-16H2,1-2H3