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

Systemtic Name: ethyl 2-(2,1,3-benzothiadiazol-5-yl)-4-oxidanylidene-4-phenyl-butanoate Openeye Name: ethyl 2-(2,1,3-benzothiadiazol-5-yl)-4-oxo-4-phenyl-butanoate CAS Name: 2-(2,1,3-benzothiadiazol-5-yl)-4-oxo-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 2-(2,1,3-benzothiadiazol-5-yl)-4-oxo-4-phenylbutanoate Traditional Name: 4-keto-4-phenyl-2-piazthiol-5-yl-butyric acid ethyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)C1=CC=CC=C1)C2=CC3=NSN=C3C=C2

Isomeric SMILES

CCOC(=O)C(CC(=O)C1=CC=CC=C1)C2=CC3=NSN=C3C=C2

InChI

InChI=1S/C18H16N2O3S/c1-2-23-18(22)14(11-17(21)12-6-4-3-5-7-12)13-8-9-15-16(10-13)20-24-19-15/h3-10,14H,2,11H2,1H3