4-chloranyl-2-methyl-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-2-methyl-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 4-chloro-2-methyl-N-(4-oxo-2-thioxo-1H-quinazolin-3-yl)-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 4-chloro-2-methyl-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 4-chloro-2-methyl-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 4-chloro-N-(4-keto-2-thioxo-1H-quinazolin-3-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C14H9ClF3N5O2S MolecularWeight: 403.76677

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(F)(F)F)Cl)C(=O)NN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CN1C(=C(C(=N1)C(F)(F)F)Cl)C(=O)NN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C14H9ClF3N5O2S/c1-22-9(8(15)10(20-22)14(16,17)18)11(24)21-23-12(25)6-4-2-3-5-7(6)19-13(23)26/h2-5H,1H3,(H,19,26)(H,21,24)