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

Systemtic Name: 4-[2-[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylethanoylamino]benzamide Openeye Name: 4-[[2-[[3-cyano-6-phenyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]acetyl]amino]benzamide CAS Name: 4-[[2-[[3-cyano-6-phenyl-4-(trifluoromethyl)-2-pyridinyl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylacetyl]amino]benzamide Traditional Name: 4-[[2-[[3-cyano-6-phenyl-4-(trifluoromethyl)-2-pyridyl]thio]acetyl]amino]benzamide Formula: C22H15F3N4O2S MolecularWeight: 456.44031

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C22H15F3N4O2S/c23-22(24,25)17-10-18(13-4-2-1-3-5-13)29-21(16(17)11-26)32-12-19(30)28-15-8-6-14(7-9-15)20(27)31/h1-10H,12H2,(H2,27,31)(H,28,30)