2-[2-[3-cyano-6-(4-ethoxyphenyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanylethanoylamino]ethanoate

Systemtic Name: 2-[2-[3-cyano-6-(4-ethoxyphenyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanylethanoylamino]ethanoate Openeye Name: 2-[[2-[[3-cyano-6-(4-ethoxyphenyl)-4-(trifluoromethyl)-2-pyridyl]sulfanyl]acetyl]amino]acetate CAS Name: 2-[[2-[[3-cyano-6-(4-ethoxyphenyl)-4-(trifluoromethyl)-2-pyridinyl]thio]-1-oxoethyl]amino]acetate IUPAC Name: 2-[[2-[3-cyano-6-(4-ethoxyphenyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[[3-cyano-6-p-phenetyl-4-(trifluoromethyl)-2-pyridyl]thio]acetyl]amino]acetate Formula: C19H15F3N3O4S- MolecularWeight: 438.40031

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)NCC(=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)NCC(=O)[O-]

InChI

InChI=1S/C19H16F3N3O4S/c1-2-29-12-5-3-11(4-6-12)15-7-14(19(20,21)22)13(8-23)18(25-15)30-10-16(26)24-9-17(27)28/h3-7H,2,9-10H2,1H3,(H,24,26)(H,27,28)/p-1