4-[3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanoylamino]benzamide

Systemtic Name: 4-[3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanoylamino]benzamide Openeye Name: 4-[3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanoylamino]benzamide CAS Name: 4-[[1-oxo-3-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propyl]amino]benzamide IUPAC Name: 4-[3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanoylamino]benzamide Traditional Name: 4-[3-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]propanoylamino]benzamide Formula: C15H13F3N4O2S MolecularWeight: 370.34953

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N)NC(=O)CCSC2=NC=CC(=N2)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)N)NC(=O)CCSC2=NC=CC(=N2)C(F)(F)F

InChI

InChI=1S/C15H13F3N4O2S/c16-15(17,18)11-5-7-20-14(22-11)25-8-6-12(23)21-10-3-1-9(2-4-10)13(19)24/h1-5,7H,6,8H2,(H2,19,24)(H,21,23)