1-(2-methyl-4-methylsulfanyl-phenyl)-3-(phenylsulfonyl)piperazine

Systemtic Name: 1-(2-methyl-4-methylsulfanyl-phenyl)-3-(phenylsulfonyl)piperazine Openeye Name: 3-(benzenesulfonyl)-1-(2-methyl-4-methylsulfanyl-phenyl)piperazine CAS Name: 3-(benzenesulfonyl)-1-[2-methyl-4-(methylthio)phenyl]piperazine IUPAC Name: 3-(benzenesulfonyl)-1-(2-methyl-4-methylsulfanylphenyl)piperazine Traditional Name: 3-besyl-1-[2-methyl-4-(methylthio)phenyl]piperazine Formula: C18H22N2O2S2 MolecularWeight: 362.50948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC)N2CCNC(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)SC)N2CCNC(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H22N2O2S2/c1-14-12-15(23-2)8-9-17(14)20-11-10-19-18(13-20)24(21,22)16-6-4-3-5-7-16/h3-9,12,18-19H,10-11,13H2,1-2H3