ethyl 1-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxo-ethyl]piperidine-4-carboxylate CAS Name: 1-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl]piperidine-4-carboxylate Traditional Name: 1-[2-keto-2-(piazthiol-4-ylamino)ethyl]isonipecotic acid ethyl ester Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC(=O)NC2=CC=CC3=NSN=C32

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC(=O)NC2=CC=CC3=NSN=C32

InChI

InChI=1S/C16H20N4O3S/c1-2-23-16(22)11-6-8-20(9-7-11)10-14(21)17-12-4-3-5-13-15(12)19-24-18-13/h3-5,11H,2,6-10H2,1H3,(H,17,21)