ethyl 6-chloranyl-2-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-4-carboxylate

Systemtic Name: ethyl 6-chloranyl-2-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-4-carboxylate Openeye Name: ethyl 6-chloro-2-oxo-pyrimido[2,1-b][1,3]benzothiazole-4-carboxylate CAS Name: 6-chloro-2-oxo-4-pyrimido[2,1-b][1,3]benzothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-2-oxopyrimido[2,1-b][1,3]benzothiazole-4-carboxylate Traditional Name: 6-chloro-2-keto-pyrimido[2,1-b][1,3]benzothiazole-4-carboxylic acid ethyl ester Formula: C13H9ClN2O3S MolecularWeight: 308.74016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=O)N=C2N1C3=C(S2)C=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1=CC(=O)N=C2N1C3=C(S2)C=CC=C3Cl

InChI

InChI=1S/C13H9ClN2O3S/c1-2-19-12(18)8-6-10(17)15-13-16(8)11-7(14)4-3-5-9(11)20-13/h3-6H,2H2,1H3