O-ethyl [4-oxidanylidene-3-[3-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanylmethanethioate

Systemtic Name: O-ethyl [4-oxidanylidene-3-[3-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanylmethanethioate Openeye Name: O-ethyl [4-oxo-3-[3-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanylmethanethioate CAS Name: [[4-oxo-3-[3-(trifluoromethyl)phenyl]-2-quinazolinyl]thio]methanethioic acid O-ethyl ester IUPAC Name: O-ethyl [4-oxo-3-[3-(trifluoromethyl)phenyl]quinazolin-2-yl]sulfanylmethanethioate Traditional Name: [[4-keto-3-[3-(trifluoromethyl)phenyl]quinazolin-2-yl]thio]methanethioic acid O-ethyl ester Formula: C18H13F3N2O2S2 MolecularWeight: 410.43323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCOC(=S)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H13F3N2O2S2/c1-2-25-17(26)27-16-22-14-9-4-3-8-13(14)15(24)23(16)12-7-5-6-11(10-12)18(19,20)21/h3-10H,2H2,1H3