ethyl 4-methylsulfanyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methylsulfanyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methylsulfanyl-2-thioxo-3-[3-(trifluoromethyl)phenyl]thiazole-5-carboxylate CAS Name: 4-(methylthio)-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methylsulfanyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxylate Traditional Name: 4-(methylthio)-2-thioxo-3-[3-(trifluoromethyl)phenyl]-4-thiazoline-5-carboxylic acid ethyl ester Formula: C14H12F3NO2S3 MolecularWeight: 379.44079

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)S1)C2=CC=CC(=C2)C(F)(F)F)SC

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)S1)C2=CC=CC(=C2)C(F)(F)F)SC

InChI

InChI=1S/C14H12F3NO2S3/c1-3-20-12(19)10-11(22-2)18(13(21)23-10)9-6-4-5-8(7-9)14(15,16)17/h4-7H,3H2,1-2H3