N-[4-(cyanomethyl)phenyl]-1-methyl-2-oxidanylidene-4-(trifluoromethyl)quinoline-6-sulfonamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-1-methyl-2-oxidanylidene-4-(trifluoromethyl)quinoline-6-sulfonamide Openeye Name: N-[4-(cyanomethyl)phenyl]-1-methyl-2-oxo-4-(trifluoromethyl)quinoline-6-sulfonamide CAS Name: N-[4-(cyanomethyl)phenyl]-1-methyl-2-oxo-4-(trifluoromethyl)-6-quinolinesulfonamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-1-methyl-2-oxo-4-(trifluoromethyl)quinoline-6-sulfonamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-keto-1-methyl-4-(trifluoromethyl)quinoline-6-sulfonamide Formula: C19H14F3N3O3S MolecularWeight: 421.39297

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)CC#N)C(=CC1=O)C(F)(F)F

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)CC#N)C(=CC1=O)C(F)(F)F

InChI

InChI=1S/C19H14F3N3O3S/c1-25-17-7-6-14(10-15(17)16(11-18(25)26)19(20,21)22)29(27,28)24-13-4-2-12(3-5-13)8-9-23/h2-7,10-11,24H,8H2,1H3