ethyl 4-[(1-pyridin-3-ylsulfonylpiperidin-3-yl)carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(1-pyridin-3-ylsulfonylpiperidin-3-yl)carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[1-(3-pyridylsulfonyl)piperidine-3-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[oxo-[1-(3-pyridinylsulfonyl)-3-piperidinyl]methyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(1-pyridin-3-ylsulfonylpiperidine-3-carbonyl)amino]piperidine-1-carboxylate Traditional Name: 4-[[1-(3-pyridylsulfonyl)nipecotoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C19H28N4O5S MolecularWeight: 424.51442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H28N4O5S/c1-2-28-19(25)22-11-7-16(8-12-22)21-18(24)15-5-4-10-23(14-15)29(26,27)17-6-3-9-20-13-17/h3,6,9,13,15-16H,2,4-5,7-8,10-12,14H2,1H3,(H,21,24)