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

Systemtic Name: ethyl 5-cyano-6-[4-[(3-fluorophenyl)methylsulfonylcarbamoyl]piperidin-1-yl]-2-methoxy-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[4-[(3-fluorophenyl)methylsulfonylcarbamoyl]-1-piperidyl]-2-methoxy-pyridine-3-carboxylate CAS Name: 5-cyano-6-[4-[[(3-fluorophenyl)methylsulfonylamino]-oxomethyl]-1-piperidinyl]-2-methoxy-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[4-[(3-fluorophenyl)methylsulfonylcarbamoyl]piperidin-1-yl]-2-methoxypyridine-3-carboxylate Traditional Name: 5-cyano-6-[4-[(3-fluorobenzyl)sulfonylcarbamoyl]piperidino]-2-methoxy-nicotinic acid ethyl ester Formula: C23H25FN4O6S MolecularWeight: 504.531203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)N2CCC(CC2)C(=O)NS(=O)(=O)CC3=CC(=CC=C3)F)OC

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)N2CCC(CC2)C(=O)NS(=O)(=O)CC3=CC(=CC=C3)F)OC

InChI

InChI=1S/C23H25FN4O6S/c1-3-34-23(30)19-12-17(13-25)20(26-22(19)33-2)28-9-7-16(8-10-28)21(29)27-35(31,32)14-15-5-4-6-18(24)11-15/h4-6,11-12,16H,3,7-10,14H2,1-2H3,(H,27,29)