2-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfanyl]-4-oxidanylidene-3-phenyl-quinazoline-7-carboxylic acid

Systemtic Name: 2-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfanyl]-4-oxidanylidene-3-phenyl-quinazoline-7-carboxylic acid Openeye Name: 2-[[3-(4-methoxyphenyl)isoxazol-5-yl]methylsulfanyl]-4-oxo-3-phenyl-quinazoline-7-carboxylic acid CAS Name: 2-[[3-(4-methoxyphenyl)-5-isoxazolyl]methylthio]-4-oxo-3-phenyl-7-quinazolinecarboxylic acid IUPAC Name: 2-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfanyl]-4-oxo-3-phenylquinazoline-7-carboxylic acid Traditional Name: 4-keto-2-[[3-(4-methoxyphenyl)isoxazol-5-yl]methylthio]-3-phenyl-quinazoline-7-carboxylic acid Formula: C26H19N3O5S MolecularWeight: 485.51116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=C2)CSC3=NC4=C(C=CC(=C4)C(=O)O)C(=O)N3C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=C2)CSC3=NC4=C(C=CC(=C4)C(=O)O)C(=O)N3C5=CC=CC=C5

InChI

InChI=1S/C26H19N3O5S/c1-33-19-10-7-16(8-11-19)22-14-20(34-28-22)15-35-26-27-23-13-17(25(31)32)9-12-21(23)24(30)29(26)18-5-3-2-4-6-18/h2-14H,15H2,1H3,(H,31,32)