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

Systemtic Name: N-[(3S)-4-cyano-5-methyl-2-oxidanylidene-3-(trifluoromethyl)-1H-pyrrol-3-yl]benzenesulfonamide Openeye Name: N-[(3S)-4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]benzenesulfonamide CAS Name: N-[(3S)-4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]benzenesulfonamide IUPAC Name: N-[(3S)-4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]benzenesulfonamide Traditional Name: N-[(3S)-4-cyano-2-keto-5-methyl-3-(trifluoromethyl)-2-pyrrolin-3-yl]benzenesulfonamide Formula: C13H10F3N3O3S MolecularWeight: 345.29701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10F3N3O3S/c1-8-10(7-17)12(11(20)18-8,13(14,15)16)19-23(21,22)9-5-3-2-4-6-9/h2-6,19H,1H3,(H,18,20)/t12-/m0/s1