methyl 4-methyl-3-propyl-2-sulfanylidene-6-[2-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=S)C2=CC=CC=C2C(F)(F)F)C(=O)OC)C

Isomeric SMILES

CCCN1C(=C(C(NC1=S)C2=CC=CC=C2C(F)(F)F)C(=O)OC)C

InChI

InChI=1S/C17H19F3N2O2S/c1-4-9-22-10(2)13(15(23)24-3)14(21-16(22)25)11-7-5-6-8-12(11)17(18,19)20/h5-8,14H,4,9H2,1-3H3,(H,21,25)