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

Systemtic Name: 3-ethoxycarbonyl-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-8-carboxylic acid Openeye Name: 3-ethoxycarbonyl-4-oxo-pyrimido[2,1-b][1,3]benzothiazole-8-carboxylic acid CAS Name: 3-ethoxycarbonyl-4-oxo-8-pyrimido[2,1-b][1,3]benzothiazolecarboxylic acid IUPAC Name: 3-ethoxycarbonyl-4-oxopyrimido[2,1-b][1,3]benzothiazole-8-carboxylic acid Traditional Name: 3-carbethoxy-4-keto-pyrimido[2,1-b][1,3]benzothiazole-8-carboxylic acid Formula: C14H10N2O5S MolecularWeight: 318.3046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2N(C1=O)C3=C(S2)C=C(C=C3)C(=O)O

Isomeric SMILES

CCOC(=O)C1=CN=C2N(C1=O)C3=C(S2)C=C(C=C3)C(=O)O

InChI

InChI=1S/C14H10N2O5S/c1-2-21-13(20)8-6-15-14-16(11(8)17)9-4-3-7(12(18)19)5-10(9)22-14/h3-6H,2H2,1H3,(H,18,19)