1-(5-chloranyl-2-methyl-phenyl)-4-(4-methylsulfanylphenyl)sulfonyl-piperazine

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-4-(4-methylsulfanylphenyl)sulfonyl-piperazine Openeye Name: 1-(5-chloro-2-methyl-phenyl)-4-(4-methylsulfanylphenyl)sulfonyl-piperazine CAS Name: 1-(5-chloro-2-methylphenyl)-4-[4-(methylthio)phenyl]sulfonylpiperazine IUPAC Name: 1-(5-chloro-2-methylphenyl)-4-(4-methylsulfanylphenyl)sulfonylpiperazine Traditional Name: 1-(5-chloro-2-methyl-phenyl)-4-[4-(methylthio)phenyl]sulfonyl-piperazine Formula: C18H21ClN2O2S2 MolecularWeight: 396.95454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C18H21ClN2O2S2/c1-14-3-4-15(19)13-18(14)20-9-11-21(12-10-20)25(22,23)17-7-5-16(24-2)6-8-17/h3-8,13H,9-12H2,1-2H3