ethyl 5-cyano-6-[4-[(4-ethylphenyl)methylsulfonylcarbamoyl]piperidin-1-yl]-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-[4-[(4-ethylphenyl)methylsulfonylcarbamoyl]piperidin-1-yl]-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[4-[(4-ethylphenyl)methylsulfonylcarbamoyl]-1-piperidyl]-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[4-[[(4-ethylphenyl)methylsulfonylamino]-oxomethyl]-1-piperidinyl]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[4-[(4-ethylphenyl)methylsulfonylcarbamoyl]piperidin-1-yl]-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[4-[(4-ethylbenzyl)sulfonylcarbamoyl]piperidino]-2-methyl-nicotinic acid ethyl ester Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CS(=O)(=O)NC(=O)C2CCN(CC2)C3=NC(=C(C=C3C#N)C(=O)OCC)C

Isomeric SMILES

CCC1=CC=C(C=C1)CS(=O)(=O)NC(=O)C2CCN(CC2)C3=NC(=C(C=C3C#N)C(=O)OCC)C

InChI

InChI=1S/C25H30N4O5S/c1-4-18-6-8-19(9-7-18)16-35(32,33)28-24(30)20-10-12-29(13-11-20)23-21(15-26)14-22(17(3)27-23)25(31)34-5-2/h6-9,14,20H,4-5,10-13,16H2,1-3H3,(H,28,30)