N-(2-ethoxyphenyl)-4-methylsulfanyl-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide

Systemtic Name: N-(2-ethoxyphenyl)-4-methylsulfanyl-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide Openeye Name: N-(2-ethoxyphenyl)-4-methylsulfanyl-3-(pyrrolidine-1-carbonyl)benzenesulfonamide CAS Name: N-(2-ethoxyphenyl)-4-(methylthio)-3-[oxo(1-pyrrolidinyl)methyl]benzenesulfonamide IUPAC Name: N-(2-ethoxyphenyl)-4-methylsulfanyl-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Traditional Name: 4-(methylthio)-N-o-phenetyl-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Formula: C20H24N2O4S2 MolecularWeight: 420.54556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)SC)C(=O)N3CCCC3

Isomeric SMILES

CCOC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)SC)C(=O)N3CCCC3

InChI

InChI=1S/C20H24N2O4S2/c1-3-26-18-9-5-4-8-17(18)21-28(24,25)15-10-11-19(27-2)16(14-15)20(23)22-12-6-7-13-22/h4-5,8-11,14,21H,3,6-7,12-13H2,1-2H3