4-methylsulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide

Systemtic Name: 4-methylsulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide Openeye Name: 4-methylsulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide CAS Name: 4-(methylthio)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzenesulfonamide IUPAC Name: 4-methylsulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide Traditional Name: 4-(methylthio)-N-(4-pyrrolidinosulfonylphenyl)benzenesulfonamide Formula: C17H20N2O4S3 MolecularWeight: 412.5467

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H20N2O4S3/c1-24-15-6-10-16(11-7-15)25(20,21)18-14-4-8-17(9-5-14)26(22,23)19-12-2-3-13-19/h4-11,18H,2-3,12-13H2,1H3