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

Systemtic Name: N-(3-methylbutyl)-4-methylsulfanyl-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide Openeye Name: N-isopentyl-4-methylsulfanyl-3-(pyrrolidine-1-carbonyl)benzenesulfonamide CAS Name: N-(3-methylbutyl)-4-(methylthio)-3-[oxo(1-pyrrolidinyl)methyl]benzenesulfonamide IUPAC Name: N-(3-methylbutyl)-4-methylsulfanyl-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Traditional Name: N-isoamyl-4-(methylthio)-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Formula: C17H26N2O3S2 MolecularWeight: 370.52994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O3S2/c1-13(2)8-9-18-24(21,22)14-6-7-16(23-3)15(12-14)17(20)19-10-4-5-11-19/h6-7,12-13,18H,4-5,8-11H2,1-3H3