ethyl 2-(4-ethyl-2-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazol-8-yl)ethanoate

Systemtic Name: ethyl 2-(4-ethyl-2-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazol-8-yl)ethanoate Openeye Name: ethyl 2-(4-ethyl-2-oxo-pyrimido[2,1-b][1,3]benzothiazol-8-yl)acetate CAS Name: 2-(4-ethyl-2-oxo-8-pyrimido[2,1-b][1,3]benzothiazolyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(4-ethyl-2-oxopyrimido[2,1-b][1,3]benzothiazol-8-yl)acetate Traditional Name: 2-(4-ethyl-2-keto-pyrimido[2,1-b][1,3]benzothiazol-8-yl)acetic acid ethyl ester Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C2N1C3=C(S2)C=C(C=C3)CC(=O)OCC

Isomeric SMILES

CCC1=CC(=O)N=C2N1C3=C(S2)C=C(C=C3)CC(=O)OCC

InChI

InChI=1S/C16H16N2O3S/c1-3-11-9-14(19)17-16-18(11)12-6-5-10(7-13(12)22-16)8-15(20)21-4-2/h5-7,9H,3-4,8H2,1-2H3