2-(2-methylquinazolin-4-yl)sulfanyl-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide

Systemtic Name: 2-(2-methylquinazolin-4-yl)sulfanyl-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide Openeye Name: 2-(2-methylquinazolin-4-yl)sulfanyl-N-(2,2,2-trifluoroethyl)acetamide CAS Name: 2-[(2-methyl-4-quinazolinyl)thio]-N-(2,2,2-trifluoroethyl)acetamide IUPAC Name: 2-(2-methylquinazolin-4-yl)sulfanyl-N-(2,2,2-trifluoroethyl)acetamide Traditional Name: 2-[(2-methylquinazolin-4-yl)thio]-N-(2,2,2-trifluoroethyl)acetamide Formula: C13H12F3N3OS MolecularWeight: 315.31409

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NCC(F)(F)F

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NCC(F)(F)F

InChI

InChI=1S/C13H12F3N3OS/c1-8-18-10-5-3-2-4-9(10)12(19-8)21-6-11(20)17-7-13(14,15)16/h2-5H,6-7H2,1H3,(H,17,20)