N-(2-ethylsulfanylphenyl)-4-methoxy-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide

Systemtic Name: N-(2-ethylsulfanylphenyl)-4-methoxy-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide Openeye Name: N-(2-ethylsulfanylphenyl)-4-methoxy-3-(pyrrolidine-1-carbonyl)benzenesulfonamide CAS Name: N-[2-(ethylthio)phenyl]-4-methoxy-3-[oxo(1-pyrrolidinyl)methyl]benzenesulfonamide IUPAC Name: N-(2-ethylsulfanylphenyl)-4-methoxy-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Traditional Name: N-[2-(ethylthio)phenyl]-4-methoxy-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Formula: C20H24N2O4S2 MolecularWeight: 420.54556

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCC3

Isomeric SMILES

CCSC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCC3

InChI

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