ethyl 6-[4-[[3,4-bis(fluoranyl)phenyl]methylsulfonylcarbamoyl]piperidin-1-yl]-5-cyano-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 6-[4-[[3,4-bis(fluoranyl)phenyl]methylsulfonylcarbamoyl]piperidin-1-yl]-5-cyano-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[4-[(3,4-difluorophenyl)methylsulfonylcarbamoyl]-1-piperidyl]-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[4-[[(3,4-difluorophenyl)methylsulfonylamino]-oxomethyl]-1-piperidinyl]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[4-[(3,4-difluorophenyl)methylsulfonylcarbamoyl]piperidin-1-yl]-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[4-[(3,4-difluorobenzyl)sulfonylcarbamoyl]piperidino]-2-methyl-nicotinic acid ethyl ester Formula: C23H24F2N4O5S MolecularWeight: 506.522266

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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(=C(C=C3)F)F)C

Isomeric SMILES

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

InChI

InChI=1S/C23H24F2N4O5S/c1-3-34-23(31)18-11-17(12-26)21(27-14(18)2)29-8-6-16(7-9-29)22(30)28-35(32,33)13-15-4-5-19(24)20(25)10-15/h4-5,10-11,16H,3,6-9,13H2,1-2H3,(H,28,30)