(2S)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-phenylsulfanyl-propan-1-one

Systemtic Name: (2S)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-phenylsulfanyl-propan-1-one Openeye Name: (2S)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-phenylsulfanyl-propan-1-one CAS Name: (2S)-1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-(phenylthio)-1-propanone IUPAC Name: (2S)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-phenylsulfanylpropan-1-one Traditional Name: (2S)-1-[4-(2,3-dimethylphenyl)piperazino]-2-(phenylthio)propan-1-one Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C(C)SC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)[C@H](C)SC3=CC=CC=C3)C

InChI

InChI=1S/C21H26N2OS/c1-16-8-7-11-20(17(16)2)22-12-14-23(15-13-22)21(24)18(3)25-19-9-5-4-6-10-19/h4-11,18H,12-15H2,1-3H3/t18-/m0/s1