N-(3-cyanophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(3-cyanophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide Openeye Name: N-(3-cyanophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide CAS Name: N-(3-cyanophenyl)-3-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide IUPAC Name: N-(3-cyanophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide Traditional Name: N-(3-cyanophenyl)-3-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]propionamide Formula: C15H11F3N4OS MolecularWeight: 352.33425

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11F3N4OS/c16-15(17,18)12-4-6-20-14(22-12)24-7-5-13(23)21-11-3-1-2-10(8-11)9-19/h1-4,6,8H,5,7H2,(H,21,23)