ethyl 5-chloranyl-2-methyl-6-[4-[(phenylmethyl)sulfonylcarbamoyl]piperidin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 5-chloranyl-2-methyl-6-[4-[(phenylmethyl)sulfonylcarbamoyl]piperidin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 6-[4-(benzylsulfonylcarbamoyl)-1-piperidyl]-5-chloro-2-methyl-pyridine-3-carboxylate CAS Name: 5-chloro-2-methyl-6-[4-[oxo-[(phenylmethyl)sulfonylamino]methyl]-1-piperidinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-(benzylsulfonylcarbamoyl)piperidin-1-yl]-5-chloro-2-methylpyridine-3-carboxylate Traditional Name: 6-[4-(benzylsulfonylcarbamoyl)piperidino]-5-chloro-2-methyl-nicotinic acid ethyl ester Formula: C22H26ClN3O5S MolecularWeight: 479.97694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(N=C1C)N2CCC(CC2)C(=O)NS(=O)(=O)CC3=CC=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(N=C1C)N2CCC(CC2)C(=O)NS(=O)(=O)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C22H26ClN3O5S/c1-3-31-22(28)18-13-19(23)20(24-15(18)2)26-11-9-17(10-12-26)21(27)25-32(29,30)14-16-7-5-4-6-8-16/h4-8,13,17H,3,9-12,14H2,1-2H3,(H,25,27)