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

Systemtic Name: 3-(2-pyrimidin-2-ylsulfanylethanoylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-[(2-pyrimidin-2-ylsulfanylacetyl)amino]-N-[3-(trifluoromethyl)phenyl]benzamide CAS Name: 3-[[1-oxo-2-(2-pyrimidinylthio)ethyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-[(2-pyrimidin-2-ylsulfanylacetyl)amino]-N-[3-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-[[2-(2-pyrimidylthio)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide Formula: C20H15F3N4O2S MolecularWeight: 432.41891

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CSC2=NC=CC=N2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CSC2=NC=CC=N2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H15F3N4O2S/c21-20(22,23)14-5-2-7-16(11-14)27-18(29)13-4-1-6-15(10-13)26-17(28)12-30-19-24-8-3-9-25-19/h1-11H,12H2,(H,26,28)(H,27,29)