ethyl 4-oxidanylidene-8-prop-2-ynoxy-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-8-prop-2-ynoxy-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylate Openeye Name: ethyl 4-oxo-8-prop-2-ynoxy-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylate CAS Name: 4-oxo-8-prop-2-ynoxy-3-pyrimido[2,1-b][1,3]benzothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-8-prop-2-ynoxypyrimido[2,1-b][1,3]benzothiazole-3-carboxylate Traditional Name: 4-keto-8-propargyloxy-pyrimido[2,1-b][1,3]benzothiazole-3-carboxylic acid ethyl ester Formula: C16H12N2O4S MolecularWeight: 328.34248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O4S/c1-3-7-22-10-5-6-12-13(8-10)23-16-17-9-11(14(19)18(12)16)15(20)21-4-2/h1,5-6,8-9H,4,7H2,2H3