2-[3-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methyl-1,2-oxazol-5-yl)propanamide

Systemtic Name: 2-[3-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methyl-1,2-oxazol-5-yl)propanamide Openeye Name: 2-[3-(3-fluoro-4-methyl-phenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(3-methylisoxazol-5-yl)propanamide CAS Name: 2-[[3-(3-fluoro-4-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(3-methyl-5-isoxazolyl)propanamide IUPAC Name: 2-[3-(3-fluoro-4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-methyl-1,2-oxazol-5-yl)propanamide Traditional Name: 2-[[3-(3-fluoro-4-methyl-phenyl)-4-keto-quinazolin-2-yl]thio]-N-(3-methylisoxazol-5-yl)propionamide Formula: C22H19FN4O3S MolecularWeight: 438.474663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=CC(=NO4)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=CC(=NO4)C)F

InChI

InChI=1S/C22H19FN4O3S/c1-12-8-9-15(11-17(12)23)27-21(29)16-6-4-5-7-18(16)24-22(27)31-14(3)20(28)25-19-10-13(2)26-30-19/h4-11,14H,1-3H3,(H,25,28)