methyl 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-4-oxidanylidene-3-phenyl-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-4-oxidanylidene-3-phenyl-quinazoline-7-carboxylate Openeye Name: methyl 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-4-oxo-3-phenyl-quinazoline-7-carboxylate CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-4-oxo-3-phenyl-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-4-oxo-3-phenylquinazoline-7-carboxylate Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-4-keto-3-phenyl-quinazoline-7-carboxylic acid methyl ester Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C22H19N3O4S/c1-13-18(14(2)29-24-13)12-30-22-23-19-11-15(21(27)28-3)9-10-17(19)20(26)25(22)16-7-5-4-6-8-16/h4-11H,12H2,1-3H3