2-(6,7-dimethoxyquinazolin-4-yl)sulfanylethanoic acid hydrochloride

Systemtic Name: 2-(6,7-dimethoxyquinazolin-4-yl)sulfanylethanoic acid hydrochloride Openeye Name: 2-(6,7-dimethoxyquinazolin-4-yl)sulfanylacetic acid hydrochloride CAS Name: 2-[(6,7-dimethoxy-4-quinazolinyl)thio]acetic acid hydrochloride IUPAC Name: 2-(6,7-dimethoxyquinazolin-4-yl)sulfanylacetic acid hydrochloride Traditional Name: 2-[(6,7-dimethoxyquinazolin-4-yl)thio]acetic acid hydrochloride Formula: C12H13ClN2O4S MolecularWeight: 316.76062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)SCC(=O)O)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)SCC(=O)O)OC.Cl

InChI

InChI=1S/C12H12N2O4S.ClH/c1-17-9-3-7-8(4-10(9)18-2)13-6-14-12(7)19-5-11(15)16;/h3-4,6H,5H2,1-2H3,(H,15,16);1H