ethyl 2-(2,1,3-benzothiadiazol-5-yl)-4-(2,3-dihydro-1-benzofuran-5-yl)-4-oxidanylidene-butanoate

Systemtic Name: ethyl 2-(2,1,3-benzothiadiazol-5-yl)-4-(2,3-dihydro-1-benzofuran-5-yl)-4-oxidanylidene-butanoate Openeye Name: ethyl 2-(2,1,3-benzothiadiazol-5-yl)-4-(2,3-dihydrobenzofuran-5-yl)-4-oxo-butanoate CAS Name: 2-(2,1,3-benzothiadiazol-5-yl)-4-(2,3-dihydrobenzofuran-5-yl)-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(2,1,3-benzothiadiazol-5-yl)-4-(2,3-dihydro-1-benzofuran-5-yl)-4-oxobutanoate Traditional Name: 4-coumaran-5-yl-4-keto-2-piazthiol-5-yl-butyric acid ethyl ester Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)C1=CC2=C(C=C1)OCC2)C3=CC4=NSN=C4C=C3

Isomeric SMILES

CCOC(=O)C(CC(=O)C1=CC2=C(C=C1)OCC2)C3=CC4=NSN=C4C=C3

InChI

InChI=1S/C20H18N2O4S/c1-2-25-20(24)15(12-3-5-16-17(10-12)22-27-21-16)11-18(23)13-4-6-19-14(9-13)7-8-26-19/h3-6,9-10,15H,2,7-8,11H2,1H3