ethyl 4-cyano-5-[2-[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanylethanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[2-[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanylethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[[2-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridyl]sulfanyl]acetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[2-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridinyl]thio]-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[[2-[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanylacetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[[2-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridyl]thio]acetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C19H15F3N4O3S2 MolecularWeight: 468.47261

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CSC2=C(C(=CC(=N2)C(F)(F)F)C)C#N)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CSC2=C(C(=CC(=N2)C(F)(F)F)C)C#N)C#N)C

InChI

InChI=1S/C19H15F3N4O3S2/c1-4-29-18(28)15-10(3)12(7-24)17(31-15)26-14(27)8-30-16-11(6-23)9(2)5-13(25-16)19(20,21)22/h5H,4,8H2,1-3H3,(H,26,27)