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

Systemtic Name: N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide Openeye Name: N-(4-oxo-2-thioxo-1H-quinazolin-3-yl)-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide CAS Name: N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide IUPAC Name: N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide Traditional Name: N-(4-keto-2-thioxo-1H-quinazolin-3-yl)-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide Formula: C13H8F3N5O2S MolecularWeight: 355.29513

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)NC(=O)C3=NNC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)NC(=O)C3=NNC(=C3)C(F)(F)F

InChI

InChI=1S/C13H8F3N5O2S/c14-13(15,16)9-5-8(18-19-9)10(22)20-21-11(23)6-3-1-2-4-7(6)17-12(21)24/h1-5H,(H,17,24)(H,18,19)(H,20,22)