2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]propanamide Openeye Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]propanamide CAS Name: 2-[(6-amino-3,5-dicyano-2-pyridinyl)thio]-N-[2-(trifluoromethyl)phenyl]propanamide IUPAC Name: 2-(6-amino-3,5-dicyanopyridin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)thio]-N-[2-(trifluoromethyl)phenyl]propionamide Formula: C17H12F3N5OS MolecularWeight: 391.37029

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(F)(F)F)SC2=C(C=C(C(=N2)N)C#N)C#N

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C(F)(F)F)SC2=C(C=C(C(=N2)N)C#N)C#N

InChI

InChI=1S/C17H12F3N5OS/c1-9(27-16-11(8-22)6-10(7-21)14(23)25-16)15(26)24-13-5-3-2-4-12(13)17(18,19)20/h2-6,9H,1H3,(H2,23,25)(H,24,26)