ethyl 7,8-bis(oxidanyl)-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylate

Systemtic Name: ethyl 7,8-bis(oxidanyl)-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylate Openeye Name: ethyl 7,8-dihydroxy-4-oxo-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylate CAS Name: 7,8-dihydroxy-4-oxo-3-pyrimido[2,1-b][1,3]benzothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 7,8-dihydroxy-4-oxopyrimido[2,1-b][1,3]benzothiazole-3-carboxylate Traditional Name: 7,8-dihydroxy-4-keto-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylic acid ethyl ester Formula: C13H10N2O5S MolecularWeight: 306.2939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2N(C1=O)C3=CC(=C(C=C3S2)O)O

Isomeric SMILES

CCOC(=O)C1=CN=C2N(C1=O)C3=CC(=C(C=C3S2)O)O

InChI

InChI=1S/C13H10N2O5S/c1-2-20-12(19)6-5-14-13-15(11(6)18)7-3-8(16)9(17)4-10(7)21-13/h3-5,16-17H,2H2,1H3