2-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanoate

Systemtic Name: 2-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanoate Openeye Name: 2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)sulfanyl]acetate CAS Name: 2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)thio]acetate IUPAC Name: 2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)sulfanyl]acetate Traditional Name: 2-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)thio]acetate Formula: C12H11N2O5S- MolecularWeight: 295.29114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)SCC(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)SCC(=O)[O-])OC

InChI

InChI=1S/C12H12N2O5S/c1-18-8-3-6-7(4-9(8)19-2)13-12(14-11(6)17)20-5-10(15)16/h3-4H,5H2,1-2H3,(H,15,16)(H,13,14,17)/p-1