ethyl 4-[[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-3-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-3-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-3-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-3-piperidinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-3-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[(1-piazthiol-4-ylsulfonylnipecotoyl)amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H27N5O5S2 MolecularWeight: 481.58888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C20H27N5O5S2/c1-2-30-20(27)24-11-8-15(9-12-24)21-19(26)14-5-4-10-25(13-14)32(28,29)17-7-3-6-16-18(17)23-31-22-16/h3,6-7,14-15H,2,4-5,8-13H2,1H3,(H,21,26)