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

Systemtic Name: ethyl 5-ethanoyl-2-methyl-6-[4-[(phenylmethyl)sulfonylcarbamoyl]piperidin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 5-acetyl-6-[4-(benzylsulfonylcarbamoyl)-1-piperidyl]-2-methyl-pyridine-3-carboxylate CAS Name: 5-acetyl-2-methyl-6-[4-[oxo-[(phenylmethyl)sulfonylamino]methyl]-1-piperidinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-6-[4-(benzylsulfonylcarbamoyl)piperidin-1-yl]-2-methylpyridine-3-carboxylate Traditional Name: 5-acetyl-6-[4-(benzylsulfonylcarbamoyl)piperidino]-2-methyl-nicotinic acid ethyl ester Formula: C24H29N3O6S MolecularWeight: 487.56856

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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)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O6S/c1-4-33-24(30)20-14-21(17(3)28)22(25-16(20)2)27-12-10-19(11-13-27)23(29)26-34(31,32)15-18-8-6-5-7-9-18/h5-9,14,19H,4,10-13,15H2,1-3H3,(H,26,29)