4-chloranyl-N-[(3S)-4-cyano-5-methyl-2-oxidanylidene-3-(trifluoromethyl)-1H-pyrrol-3-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(3S)-4-cyano-5-methyl-2-oxidanylidene-3-(trifluoromethyl)-1H-pyrrol-3-yl]benzenesulfonamide Openeye Name: 4-chloro-N-[(3S)-4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]benzenesulfonamide CAS Name: 4-chloro-N-[(3S)-4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]benzenesulfonamide IUPAC Name: 4-chloro-N-[(3S)-4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]benzenesulfonamide Traditional Name: 4-chloro-N-[(3S)-4-cyano-2-keto-5-methyl-3-(trifluoromethyl)-2-pyrrolin-3-yl]benzenesulfonamide Formula: C13H9ClF3N3O3S MolecularWeight: 379.74207

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=O)N1)(C(F)(F)F)NS(=O)(=O)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CC1=C([C@](C(=O)N1)(C(F)(F)F)NS(=O)(=O)C2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C13H9ClF3N3O3S/c1-7-10(6-18)12(11(21)19-7,13(15,16)17)20-24(22,23)9-4-2-8(14)3-5-9/h2-5,20H,1H3,(H,19,21)/t12-/m0/s1