N-[(4-methoxyphenyl)methyl]-4-methylsulfanyl-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNS(=O)(=O)C2=CC(=C(C=C2)SC)C(=O)N3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)CNS(=O)(=O)C2=CC(=C(C=C2)SC)C(=O)N3CCCC3

InChI

InChI=1S/C20H24N2O4S2/c1-26-16-7-5-15(6-8-16)14-21-28(24,25)17-9-10-19(27-2)18(13-17)20(23)22-11-3-4-12-22/h5-10,13,21H,3-4,11-12,14H2,1-2H3