ethyl 4-(2-methoxynaphthalen-1-yl)-2-sulfanylidene-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(2-methoxynaphthalen-1-yl)-2-sulfanylidene-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(2-methoxy-1-naphthyl)-2-thioxo-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(2-methoxy-1-naphthalenyl)-2-sulfanylidene-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-methoxynaphthalen-1-yl)-2-sulfanylidene-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(2-methoxy-1-naphthyl)-2-thioxo-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H17F3N2O3S MolecularWeight: 410.41009

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=S)NC1C2=C(C=CC3=CC=CC=C32)OC)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(NC(=S)NC1C2=C(C=CC3=CC=CC=C32)OC)C(F)(F)F

InChI

InChI=1S/C19H17F3N2O3S/c1-3-27-17(25)14-15(23-18(28)24-16(14)19(20,21)22)13-11-7-5-4-6-10(11)8-9-12(13)26-2/h4-9,15H,3H2,1-2H3,(H2,23,24,28)