2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethanamide

Systemtic Name: 2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethanamide Openeye Name: 2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-oxo-2-thioxo-1H-quinazolin-3-yl)acetamide CAS Name: 2-[5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)acetamide IUPAC Name: 2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)acetamide Traditional Name: N-(4-keto-2-thioxo-1H-quinazolin-3-yl)-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide Formula: C15H12F3N5O2S MolecularWeight: 383.34829

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=O)NN2C(=O)C3=CC=CC=C3NC2=S)C(F)(F)F

Isomeric SMILES

CC1=CC(=NN1CC(=O)NN2C(=O)C3=CC=CC=C3NC2=S)C(F)(F)F

InChI

InChI=1S/C15H12F3N5O2S/c1-8-6-11(15(16,17)18)20-22(8)7-12(24)21-23-13(25)9-4-2-3-5-10(9)19-14(23)26/h2-6H,7H2,1H3,(H,19,26)(H,21,24)