ethyl 1,3,6-trimethyl-2-sulfanylidene-4-[2-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1,3,6-trimethyl-2-sulfanylidene-4-[2-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 1,3,6-trimethyl-2-thioxo-4-[2-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carboxylate CAS Name: 1,3,6-trimethyl-2-sulfanylidene-4-[2-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 1,3,6-trimethyl-2-sulfanylidene-4-[2-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carboxylate Traditional Name: 1,3,6-trimethyl-2-thioxo-4-[2-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C17H19F3N2O2S MolecularWeight: 372.40517

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)N(C1C2=CC=CC=C2C(F)(F)F)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)N(C1C2=CC=CC=C2C(F)(F)F)C)C)C

InChI

InChI=1S/C17H19F3N2O2S/c1-5-24-15(23)13-10(2)21(3)16(25)22(4)14(13)11-8-6-7-9-12(11)17(18,19)20/h6-9,14H,5H2,1-4H3