N-(2,4-dimethylpentan-3-yl)-4-methylsulfanyl-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide

Systemtic Name: N-(2,4-dimethylpentan-3-yl)-4-methylsulfanyl-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide Openeye Name: N-(1-isopropyl-2-methyl-propyl)-4-methylsulfanyl-3-(pyrrolidine-1-carbonyl)benzenesulfonamide CAS Name: N-(2,4-dimethylpentan-3-yl)-4-(methylthio)-3-[oxo(1-pyrrolidinyl)methyl]benzenesulfonamide IUPAC Name: N-(2,4-dimethylpentan-3-yl)-4-methylsulfanyl-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Traditional Name: N-(1-isopropyl-2-methyl-propyl)-4-(methylthio)-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Formula: C19H30N2O3S2 MolecularWeight: 398.5831

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)C)NS(=O)(=O)C1=CC(=C(C=C1)SC)C(=O)N2CCCC2

Isomeric SMILES

CC(C)C(C(C)C)NS(=O)(=O)C1=CC(=C(C=C1)SC)C(=O)N2CCCC2

InChI

InChI=1S/C19H30N2O3S2/c1-13(2)18(14(3)4)20-26(23,24)15-8-9-17(25-5)16(12-15)19(22)21-10-6-7-11-21/h8-9,12-14,18,20H,6-7,10-11H2,1-5H3