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

Systemtic Name: 4-methyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(4-phenethylpiperidin-1-yl)butan-2-yl]benzenesulfonamide Openeye Name: 4-methyl-N-[3-methylsulfanyl-1-(4-phenethylpiperidine-1-carbonyl)propyl]benzenesulfonamide CAS Name: 4-methyl-N-[4-(methylthio)-1-oxo-1-(4-phenethyl-1-piperidinyl)butan-2-yl]benzenesulfonamide IUPAC Name: 4-methyl-N-[4-methylsulfanyl-1-oxo-1-(4-phenethylpiperidin-1-yl)butan-2-yl]benzenesulfonamide Traditional Name: 4-methyl-N-[3-(methylthio)-1-(4-phenethylpiperidine-1-carbonyl)propyl]benzenesulfonamide Formula: C25H34N2O3S2 MolecularWeight: 474.67906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)N2CCC(CC2)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)N2CCC(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C25H34N2O3S2/c1-20-8-12-23(13-9-20)32(29,30)26-24(16-19-31-2)25(28)27-17-14-22(15-18-27)11-10-21-6-4-3-5-7-21/h3-9,12-13,22,24,26H,10-11,14-19H2,1-2H3