2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide

Systemtic Name: 2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide Openeye Name: 2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2,2,2-trifluoroethyl)acetamide CAS Name: 2-[(3-methyl-4-oxo-2-quinazolinyl)thio]-N-(2,2,2-trifluoroethyl)acetamide IUPAC Name: 2-(3-methyl-4-oxoquinazolin-2-yl)sulfanyl-N-(2,2,2-trifluoroethyl)acetamide Traditional Name: 2-[(4-keto-3-methyl-quinazolin-2-yl)thio]-N-(2,2,2-trifluoroethyl)acetamide Formula: C13H12F3N3O2S MolecularWeight: 331.31349

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC(F)(F)F

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC(F)(F)F

InChI

InChI=1S/C13H12F3N3O2S/c1-19-11(21)8-4-2-3-5-9(8)18-12(19)22-6-10(20)17-7-13(14,15)16/h2-5H,6-7H2,1H3,(H,17,20)