3-(2-pyridin-2-ylsulfanylethanoylamino)-N-[3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 3-(2-pyridin-2-ylsulfanylethanoylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-[[2-(2-pyridylsulfanyl)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide CAS Name: 3-[[1-oxo-2-(2-pyridinylthio)ethyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-[(2-pyridin-2-ylsulfanylacetyl)amino]-N-[3-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-[[2-(2-pyridylthio)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide Formula: C21H16F3N3O2S MolecularWeight: 431.43085

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SCC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC=NC(=C1)SCC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H16F3N3O2S/c22-21(23,24)15-6-4-8-17(12-15)27-20(29)14-5-3-7-16(11-14)26-18(28)13-30-19-9-1-2-10-25-19/h1-12H,13H2,(H,26,28)(H,27,29)