2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]propanamide Openeye Name: 2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]propanamide CAS Name: 2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]-N-[2-(trifluoromethyl)phenyl]propanamide IUPAC Name: 2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-[2-(trifluoromethyl)phenyl]propionamide Formula: C21H20F3N3O2S MolecularWeight: 435.46261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H20F3N3O2S/c1-12(2)27-19(29)14-8-4-6-10-16(14)26-20(27)30-13(3)18(28)25-17-11-7-5-9-15(17)21(22,23)24/h4-13H,1-3H3,(H,25,28)