methyl 2-[4-oxidanylidene-2-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[4-oxidanylidene-2-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[4-oxo-2-[(5-phenylisoxazol-3-yl)methylsulfanyl]quinazolin-3-yl]acetate CAS Name: 2-[4-oxo-2-[(5-phenyl-3-isoxazolyl)methylthio]-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-oxo-2-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-3-yl]acetate Traditional Name: 2-[4-keto-2-[(5-phenylisoxazol-3-yl)methylthio]quinazolin-3-yl]acetic acid methyl ester Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC3=NOC(=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC3=NOC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O4S/c1-27-19(25)12-24-20(26)16-9-5-6-10-17(16)22-21(24)29-13-15-11-18(28-23-15)14-7-3-2-4-8-14/h2-11H,12-13H2,1H3