2-[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methyl-1,2-oxazol-5-yl)ethanamide

Systemtic Name: 2-[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methyl-1,2-oxazol-5-yl)ethanamide Openeye Name: 2-[3-(2,6-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(3-methylisoxazol-5-yl)acetamide CAS Name: 2-[[3-(2,6-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(3-methyl-5-isoxazolyl)acetamide IUPAC Name: 2-[3-(2,6-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-methyl-1,2-oxazol-5-yl)acetamide Traditional Name: 2-[[3-(2,6-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]-N-(3-methylisoxazol-5-yl)acetamide Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=NO4)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=NO4)C

InChI

InChI=1S/C22H20N4O3S/c1-13-7-6-8-14(2)20(13)26-21(28)16-9-4-5-10-17(16)23-22(26)30-12-18(27)24-19-11-15(3)25-29-19/h4-11H,12H2,1-3H3,(H,24,27)