4-[2-[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanylethanoylamino]benzamide

Systemtic Name: 4-[2-[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanylethanoylamino]benzamide Openeye Name: 4-[[2-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridyl]sulfanyl]acetyl]amino]benzamide CAS Name: 4-[[2-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridinyl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanylacetyl]amino]benzamide Traditional Name: 4-[[2-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridyl]thio]acetyl]amino]benzamide Formula: C17H13F3N4O2S MolecularWeight: 394.37093

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(=O)NC2=CC=C(C=C2)C(=O)N)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(=O)NC2=CC=C(C=C2)C(=O)N)C(F)(F)F

InChI

InChI=1S/C17H13F3N4O2S/c1-9-6-13(17(18,19)20)24-16(12(9)7-21)27-8-14(25)23-11-4-2-10(3-5-11)15(22)26/h2-6H,8H2,1H3,(H2,22,26)(H,23,25)