ethyl 5-cyano-6-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-2-(trifluoromethyl)pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-2-(trifluoromethyl)pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-2-(trifluoromethyl)pyridine-3-carboxylate CAS Name: 5-cyano-6-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]-2-(trifluoromethyl)-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-2-(trifluoromethyl)pyridine-3-carboxylate Traditional Name: 5-cyano-6-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]-2-(trifluoromethyl)nicotinic acid ethyl ester Formula: C13H9F3N4O2S3 MolecularWeight: 406.42637

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SC2=NN=C(S2)SC)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SC2=NN=C(S2)SC)C(F)(F)F

InChI

InChI=1S/C13H9F3N4O2S3/c1-3-22-10(21)7-4-6(5-17)9(18-8(7)13(14,15)16)24-12-20-19-11(23-2)25-12/h4H,3H2,1-2H3