N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxidanylidene-8-(trifluoromethyl)-1H-quinoline-3-carboxamide

Systemtic Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxidanylidene-8-(trifluoromethyl)-1H-quinoline-3-carboxamide Openeye Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxamide CAS Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxamide IUPAC Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxamide Traditional Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-keto-8-(trifluoromethyl)-1H-quinoline-3-carboxamide Formula: C17H15F3N4O2S MolecularWeight: 396.38681

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(S1)NC(=O)C2=CNC3=C(C2=O)C=CC=C3C(F)(F)F

Isomeric SMILES

CC(C)CC1=NN=C(S1)NC(=O)C2=CNC3=C(C2=O)C=CC=C3C(F)(F)F

InChI

InChI=1S/C17H15F3N4O2S/c1-8(2)6-12-23-24-16(27-12)22-15(26)10-7-21-13-9(14(10)25)4-3-5-11(13)17(18,19)20/h3-5,7-8H,6H2,1-2H3,(H,21,25)(H,22,24,26)