N-(3-methylphenyl)-4-methylsulfanyl-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide

Systemtic Name: N-(3-methylphenyl)-4-methylsulfanyl-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide Openeye Name: 4-methylsulfanyl-N-(m-tolyl)-3-(pyrrolidine-1-carbonyl)benzenesulfonamide CAS Name: N-(3-methylphenyl)-4-(methylthio)-3-[oxo(1-pyrrolidinyl)methyl]benzenesulfonamide IUPAC Name: N-(3-methylphenyl)-4-methylsulfanyl-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Traditional Name: 4-(methylthio)-N-(m-tolyl)-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Formula: C19H22N2O3S2 MolecularWeight: 390.51958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)SC)C(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)SC)C(=O)N3CCCC3

InChI

InChI=1S/C19H22N2O3S2/c1-14-6-5-7-15(12-14)20-26(23,24)16-8-9-18(25-2)17(13-16)19(22)21-10-3-4-11-21/h5-9,12-13,20H,3-4,10-11H2,1-2H3