4-methyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]butan-2-yl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]butan-2-yl]benzenesulfonamide Openeye Name: N-[1-(4-benzylpiperazine-1-carbonyl)-3-methylsulfanyl-propyl]-4-methyl-benzenesulfonamide CAS Name: 4-methyl-N-[4-(methylthio)-1-oxo-1-[4-(phenylmethyl)-1-piperazinyl]butan-2-yl]benzenesulfonamide IUPAC Name: N-[1-(4-benzylpiperazin-1-yl)-4-methylsulfanyl-1-oxobutan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[1-(4-benzylpiperazine-1-carbonyl)-3-(methylthio)propyl]-4-methyl-benzenesulfonamide Formula: C23H31N3O3S2 MolecularWeight: 461.64054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O3S2/c1-19-8-10-21(11-9-19)31(28,29)24-22(12-17-30-2)23(27)26-15-13-25(14-16-26)18-20-6-4-3-5-7-20/h3-11,22,24H,12-18H2,1-2H3