N-(5-methyl-1,2-oxazol-3-yl)-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-2-phenyl-ethanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-2-phenyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(5-methylisoxazol-3-yl)-2-phenyl-acetamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-2-phenylacetamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-2-phenylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(5-methylisoxazol-3-yl)-2-phenyl-acetamide Formula: C23H20N4O3S MolecularWeight: 432.4949

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3CC=C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3CC=C

InChI

InChI=1S/C23H20N4O3S/c1-3-13-27-22(29)17-11-7-8-12-18(17)24-23(27)31-20(16-9-5-4-6-10-16)21(28)25-19-14-15(2)30-26-19/h3-12,14,20H,1,13H2,2H3,(H,25,26,28)