7,8-dimethoxy-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylic acid

Systemtic Name: 7,8-dimethoxy-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylic acid Openeye Name: 7,8-dimethoxy-4-oxo-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylic acid CAS Name: 7,8-dimethoxy-4-oxo-3-pyrimido[2,1-b][1,3]benzothiazolecarboxylic acid IUPAC Name: 7,8-dimethoxy-4-oxopyrimido[2,1-b][1,3]benzothiazole-3-carboxylic acid Traditional Name: 4-keto-7,8-dimethoxy-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylic acid Formula: C13H10N2O5S MolecularWeight: 306.2939

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N3C(=O)C(=CN=C3S2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N3C(=O)C(=CN=C3S2)C(=O)O)OC

InChI

InChI=1S/C13H10N2O5S/c1-19-8-3-7-10(4-9(8)20-2)21-13-14-5-6(12(17)18)11(16)15(7)13/h3-5H,1-2H3,(H,17,18)