2-(6,7-dimethoxy-3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoic acid

Systemtic Name: 2-(6,7-dimethoxy-3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoic acid Openeye Name: 2-(6,7-dimethoxy-3-methyl-4-oxo-quinazolin-2-yl)sulfanylacetic acid CAS Name: 2-[(6,7-dimethoxy-3-methyl-4-oxo-2-quinazolinyl)thio]acetic acid IUPAC Name: 2-(6,7-dimethoxy-3-methyl-4-oxoquinazolin-2-yl)sulfanylacetic acid Traditional Name: 2-[(4-keto-6,7-dimethoxy-3-methyl-quinazolin-2-yl)thio]acetic acid Formula: C13H14N2O5S MolecularWeight: 310.32566

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC(=C(C=C2N=C1SCC(=O)O)OC)OC

Isomeric SMILES

CN1C(=O)C2=CC(=C(C=C2N=C1SCC(=O)O)OC)OC

InChI

InChI=1S/C13H14N2O5S/c1-15-12(18)7-4-9(19-2)10(20-3)5-8(7)14-13(15)21-6-11(16)17/h4-5H,6H2,1-3H3,(H,16,17)