[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(methylsulfanylmethyl)phenyl]methanone

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(methylsulfanylmethyl)phenyl]methanone Openeye Name: [4-(methylsulfanylmethyl)phenyl]-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-[4-[(methylthio)methyl]phenyl]methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(methylsulfanylmethyl)phenyl]methanone Traditional Name: [4-[(methylthio)methyl]phenyl]-(4-tosylpiperazino)methanone Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O3S2/c1-16-3-9-19(10-4-16)27(24,25)22-13-11-21(12-14-22)20(23)18-7-5-17(6-8-18)15-26-2/h3-10H,11-15H2,1-2H3