N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-methyl-N-[[4-(methylthio)phenyl]methyl]-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-methyl-N-[4-(methylthio)benzyl]-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C19H24N2O4S3 MolecularWeight: 440.59986

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H24N2O4S3/c1-20(15-16-5-7-17(26-2)8-6-16)27(22,23)18-9-11-19(12-10-18)28(24,25)21-13-3-4-14-21/h5-12H,3-4,13-15H2,1-2H3