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

Systemtic Name: methyl 2-[4-oxidanylidene-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[4-oxo-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]quinazolin-3-yl]acetate CAS Name: 2-[4-oxo-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-oxo-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]quinazolin-3-yl]acetate Traditional Name: 2-[4-keto-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]quinazolin-3-yl]acetic acid methyl ester Formula: C20H16N4O4S MolecularWeight: 408.43044

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C20H16N4O4S/c1-27-17(25)11-24-19(26)14-9-5-6-10-15(14)21-20(24)29-12-16-22-18(23-28-16)13-7-3-2-4-8-13/h2-10H,11-12H2,1H3