methyl 2-[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]sulfanylethanoate

Systemtic Name: methyl 2-[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]sulfanylethanoate Openeye Name: methyl 2-[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetate CAS Name: 2-[[7-methoxy-2-(trifluoromethyl)-4-quinazolinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetate Traditional Name: 2-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]thio]acetic acid methyl ester Formula: C13H11F3N2O3S MolecularWeight: 332.29825

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NC(=N2)C(F)(F)F)SCC(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NC(=N2)C(F)(F)F)SCC(=O)OC

InChI

InChI=1S/C13H11F3N2O3S/c1-20-7-3-4-8-9(5-7)17-12(13(14,15)16)18-11(8)22-6-10(19)21-2/h3-5H,6H2,1-2H3