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

Systemtic Name: 2-[3-[bis(fluoranyl)methyl]-5-methyl-pyrazol-1-yl]-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethanamide Openeye Name: 2-[3-(difluoromethyl)-5-methyl-pyrazol-1-yl]-N-(4-oxo-2-thioxo-1H-quinazolin-3-yl)acetamide CAS Name: 2-[3-(difluoromethyl)-5-methyl-1-pyrazolyl]-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)acetamide IUPAC Name: 2-[3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)acetamide Traditional Name: 2-[3-(difluoromethyl)-5-methyl-pyrazol-1-yl]-N-(4-keto-2-thioxo-1H-quinazolin-3-yl)acetamide Formula: C15H13F2N5O2S MolecularWeight: 365.357826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13F2N5O2S/c1-8-6-11(13(16)17)19-21(8)7-12(23)20-22-14(24)9-4-2-3-5-10(9)18-15(22)25/h2-6,13H,7H2,1H3,(H,18,25)(H,20,23)