methyl (4R)-6-propyl-2-sulfanylidene-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4R)-6-propyl-2-sulfanylidene-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4R)-6-propyl-2-thioxo-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-propyl-2-sulfanylidene-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4R)-6-propyl-2-sulfanylidene-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-6-propyl-2-thioxo-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C16H17F3N2O2S MolecularWeight: 358.37859

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(NC(=S)N1)C2=CC=CC=C2C(F)(F)F)C(=O)OC

Isomeric SMILES

CCCC1=C([C@H](NC(=S)N1)C2=CC=CC=C2C(F)(F)F)C(=O)OC

InChI

InChI=1S/C16H17F3N2O2S/c1-3-6-11-12(14(22)23-2)13(21-15(24)20-11)9-7-4-5-8-10(9)16(17,18)19/h4-5,7-8,13H,3,6H2,1-2H3,(H2,20,21,24)/t13-/m1/s1