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

Systemtic Name: ethyl 5-cyano-2-ethyl-6-[4-[(4-fluorophenyl)methylsulfonylcarbamoyl]piperidin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-ethyl-6-[4-[(4-fluorophenyl)methylsulfonylcarbamoyl]-1-piperidyl]pyridine-3-carboxylate CAS Name: 5-cyano-2-ethyl-6-[4-[[(4-fluorophenyl)methylsulfonylamino]-oxomethyl]-1-piperidinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-ethyl-6-[4-[(4-fluorophenyl)methylsulfonylcarbamoyl]piperidin-1-yl]pyridine-3-carboxylate Traditional Name: 5-cyano-2-ethyl-6-[4-[(4-fluorobenzyl)sulfonylcarbamoyl]piperidino]nicotinic acid ethyl ester Formula: C24H27FN4O5S MolecularWeight: 502.558383

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=N1)N2CCC(CC2)C(=O)NS(=O)(=O)CC3=CC=C(C=C3)F)C#N)C(=O)OCC

Isomeric SMILES

CCC1=C(C=C(C(=N1)N2CCC(CC2)C(=O)NS(=O)(=O)CC3=CC=C(C=C3)F)C#N)C(=O)OCC

InChI

InChI=1S/C24H27FN4O5S/c1-3-21-20(24(31)34-4-2)13-18(14-26)22(27-21)29-11-9-17(10-12-29)23(30)28-35(32,33)15-16-5-7-19(25)8-6-16/h5-8,13,17H,3-4,9-12,15H2,1-2H3,(H,28,30)