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

Systemtic Name: methyl 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxylate Openeye Name: methyl 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-4-oxo-3-phenethyl-quinazoline-7-carboxylate CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-4-oxo-3-phenethyl-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-4-oxo-3-phenethylquinazoline-7-carboxylate Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-4-keto-3-phenethyl-quinazoline-7-carboxylic acid methyl ester Formula: C24H23N3O4S MolecularWeight: 449.52212

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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)N2CCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CCC4=CC=CC=C4

InChI

InChI=1S/C24H23N3O4S/c1-15-20(16(2)31-26-15)14-32-24-25-21-13-18(23(29)30-3)9-10-19(21)22(28)27(24)12-11-17-7-5-4-6-8-17/h4-10,13H,11-12,14H2,1-3H3