3-[2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylethanoyl-(2-methoxyphenyl)amino]propanamide

Systemtic Name: 3-[2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylethanoyl-(2-methoxyphenyl)amino]propanamide Openeye Name: 3-(N-[2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]acetyl]-2-methoxy-anilino)propanamide CAS Name: 3-(N-[2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]-1-oxoethyl]-2-methoxyanilino)propanamide IUPAC Name: 3-(N-[2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylacetyl]-2-methoxyanilino)propanamide Traditional Name: 3-(N-[2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]thio]acetyl]-2-methoxy-anilino)propionamide Formula: C20H19F3N4O3S MolecularWeight: 452.45007

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCC(=O)N(CCC(=O)N)C2=CC=CC=C2OC

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCC(=O)N(CCC(=O)N)C2=CC=CC=C2OC

InChI

InChI=1S/C20H19F3N4O3S/c1-12-9-14(20(21,22)23)13(10-24)19(26-12)31-11-18(29)27(8-7-17(25)28)15-5-3-4-6-16(15)30-2/h3-6,9H,7-8,11H2,1-2H3,(H2,25,28)