ethyl 2-[6-oxidanylidene-1-prop-2-enyl-4-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[6-oxidanylidene-1-prop-2-enyl-4-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[1-allyl-6-oxo-4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[6-oxo-1-prop-2-enyl-4-(trifluoromethyl)-2-pyrimidinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-oxo-1-prop-2-enyl-4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[1-allyl-6-keto-4-(trifluoromethyl)pyrimidin-2-yl]thio]acetic acid ethyl ester Formula: C12H13F3N2O3S MolecularWeight: 322.30343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=CC(=O)N1CC=C)C(F)(F)F

Isomeric SMILES

CCOC(=O)CSC1=NC(=CC(=O)N1CC=C)C(F)(F)F

InChI

InChI=1S/C12H13F3N2O3S/c1-3-5-17-9(18)6-8(12(13,14)15)16-11(17)21-7-10(19)20-4-2/h3,6H,1,4-5,7H2,2H3