2-[6-azanyl-4-oxidanylidene-2-(trifluoromethyl)quinazolin-3-yl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[6-azanyl-4-oxidanylidene-2-(trifluoromethyl)quinazolin-3-yl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[6-amino-4-oxo-2-(trifluoromethyl)quinazolin-3-yl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[6-amino-4-oxo-2-(trifluoromethyl)-3-quinazolinyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[6-amino-4-oxo-2-(trifluoromethyl)quinazolin-3-yl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[6-amino-4-keto-2-(trifluoromethyl)quinazolin-3-yl]-4-methyl-thiazole-5-carboxylic acid Formula: C14H9F3N4O3S MolecularWeight: 370.30647

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2C(=O)C3=C(C=CC(=C3)N)N=C2C(F)(F)F)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)N2C(=O)C3=C(C=CC(=C3)N)N=C2C(F)(F)F)C(=O)O

InChI

InChI=1S/C14H9F3N4O3S/c1-5-9(11(23)24)25-13(19-5)21-10(22)7-4-6(18)2-3-8(7)20-12(21)14(15,16)17/h2-4H,18H2,1H3,(H,23,24)