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[4-sulfanylidene-6-(trifluoromethyl)-1,2-dihydropyrimidin-3-yl] benzoate

[4-sulfanylidene-6-(trifluoromethyl)-1,2-dihydropyrimidin-3-yl] benzoate

Systemtic Name:[4-sulfanylidene-6-(trifluoromethyl)-1,2-dihydropyrimidin-3-yl] benzoate
Openeye Name:[4-thioxo-6-(trifluoromethyl)-1,2-dihydropyrimidin-3-yl] benzoate
CAS Name:benzoic acid [4-sulfanylidene-6-(trifluoromethyl)-1,2-dihydropyrimidin-3-yl] ester
IUPAC Name:[4-sulfanylidene-6-(trifluoromethyl)-1,2-dihydropyrimidin-3-yl] benzoate
Traditional Name:benzoic acid [4-thioxo-6-(trifluoromethyl)-1,2-dihydropyrimidin-3-yl] ester
Formula: C12H9F3N2O2S
MolecularWeight: 302.27227
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Descriptors Computed from Structure

Canonical SMILES:

C1NC(=CC(=S)N1OC(=O)C2=CC=CC=C2)C(F)(F)F


Isomeric SMILES

C1NC(=CC(=S)N1OC(=O)C2=CC=CC=C2)C(F)(F)F


InChI

InChI=1S/C12H9F3N2O2S/c13-12(14,15)9-6-10(20)17(7-16-9)19-11(18)8-4-2-1-3-5-8/h1-6,16H,7H2


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