ethyl 4-[[4-[(4-acetamido-3-chloranyl-phenyl)sulfonylamino]piperidin-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[4-[(4-acetamido-3-chloranyl-phenyl)sulfonylamino]piperidin-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[4-[(4-acetamido-3-chloro-phenyl)sulfonylamino]piperidine-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[4-[(4-acetamido-3-chlorophenyl)sulfonylamino]-4-piperidinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-[(4-acetamido-3-chlorophenyl)sulfonylamino]piperidine-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[4-[(4-acetamido-3-chloro-phenyl)sulfonylamino]isonipecotoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C22H32ClN5O6S MolecularWeight: 530.03738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2(CCNCC2)NS(=O)(=O)C3=CC(=C(C=C3)NC(=O)C)Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2(CCNCC2)NS(=O)(=O)C3=CC(=C(C=C3)NC(=O)C)Cl

InChI

InChI=1S/C22H32ClN5O6S/c1-3-34-21(31)28-12-6-16(7-13-28)26-20(30)22(8-10-24-11-9-22)27-35(32,33)17-4-5-19(18(23)14-17)25-15(2)29/h4-5,14,16,24,27H,3,6-13H2,1-2H3,(H,25,29)(H,26,30)