ethyl 6-[3,5-bis(trifluoromethyl)phenyl]-2-sulfanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[3,5-bis(trifluoromethyl)phenyl]-2-sulfanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[3,5-bis(trifluoromethyl)phenyl]-4-(2-thienyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[3,5-bis(trifluoromethyl)phenyl]-2-sulfanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[3,5-bis(trifluoromethyl)phenyl]-2-sulfanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[3,5-bis(trifluoromethyl)phenyl]-4-(2-thienyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H14F6N2O2S2 MolecularWeight: 480.447079

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=S)NC1C2=CC=CS2)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(NC(=S)NC1C2=CC=CS2)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C19H14F6N2O2S2/c1-2-29-16(28)13-14(26-17(30)27-15(13)12-4-3-5-31-12)9-6-10(18(20,21)22)8-11(7-9)19(23,24)25/h3-8,15H,2H2,1H3,(H2,26,27,30)