N-(3-methylsulfanylphenyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-(3-methylsulfanylphenyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-(3-methylsulfanylphenyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[3-(methylthio)phenyl]-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-(3-methylsulfanylphenyl)-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-[3-(methylthio)phenyl]-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C17H20N2O4S3 MolecularWeight: 412.5467

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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