2-(1-methylimidazol-2-yl)sulfanyl-N-[2,3,4-tris(fluoranyl)phenyl]propanamide

Systemtic Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-[2,3,4-tris(fluoranyl)phenyl]propanamide Openeye Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-(2,3,4-trifluorophenyl)propanamide CAS Name: 2-[(1-methyl-2-imidazolyl)thio]-N-(2,3,4-trifluorophenyl)propanamide IUPAC Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-(2,3,4-trifluorophenyl)propanamide Traditional Name: 2-[(1-methylimidazol-2-yl)thio]-N-(2,3,4-trifluorophenyl)propionamide Formula: C13H12F3N3OS MolecularWeight: 315.31409

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C(=C(C=C1)F)F)F)SC2=NC=CN2C

Isomeric SMILES

CC(C(=O)NC1=C(C(=C(C=C1)F)F)F)SC2=NC=CN2C

InChI

InChI=1S/C13H12F3N3OS/c1-7(21-13-17-5-6-19(13)2)12(20)18-9-4-3-8(14)10(15)11(9)16/h3-7H,1-2H3,(H,18,20)