2-[4-oxidanylidene-3-[2-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanylethanamide

Systemtic Name: 2-[4-oxidanylidene-3-[2-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanylethanamide Openeye Name: 2-[4-oxo-3-[2-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanylacetamide CAS Name: 2-[[4-oxo-3-[2-(trifluoromethyl)phenyl]-2-quinazolinyl]thio]acetamide IUPAC Name: 2-[4-oxo-3-[2-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-keto-3-[2-(trifluoromethyl)phenyl]quinazolin-2-yl]thio]acetamide Formula: C17H12F3N3O2S MolecularWeight: 379.35629

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)N)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)N)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C17H12F3N3O2S/c18-17(19,20)11-6-2-4-8-13(11)23-15(25)10-5-1-3-7-12(10)22-16(23)26-9-14(21)24/h1-8H,9H2,(H2,21,24)