N-[[(3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[[(3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methyl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[[(3S)-5-oxo-1-(p-tolyl)pyrrolidin-3-yl]methyl]-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[[(3S)-1-(4-methylphenyl)-5-oxo-3-pyrrolidinyl]methyl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[[(3S)-1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]methyl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[[(3S)-5-keto-1-(p-tolyl)pyrrolidin-3-yl]methyl]-3-(trifluoromethyl)benzenesulfonamide Formula: C19H19F3N2O3S MolecularWeight: 412.42597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)CNS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)N2C[C@H](CC2=O)CNS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H19F3N2O3S/c1-13-5-7-16(8-6-13)24-12-14(9-18(24)25)11-23-28(26,27)17-4-2-3-15(10-17)19(20,21)22/h2-8,10,14,23H,9,11-12H2,1H3/t14-/m1/s1