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

Systemtic Name: ethyl 5-cyano-6-[4-[(4-cyanophenyl)methylsulfonylcarbamoyl]piperidin-1-yl]-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[4-[(4-cyanophenyl)methylsulfonylcarbamoyl]-1-piperidyl]-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[4-[[(4-cyanophenyl)methylsulfonylamino]-oxomethyl]-1-piperidinyl]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[4-[(4-cyanophenyl)methylsulfonylcarbamoyl]piperidin-1-yl]-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[4-[(4-cyanobenzyl)sulfonylcarbamoyl]piperidino]-2-methyl-nicotinic acid ethyl ester Formula: C24H25N5O5S MolecularWeight: 495.5508

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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)C#N)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)C#N)C

InChI

InChI=1S/C24H25N5O5S/c1-3-34-24(31)21-12-20(14-26)22(27-16(21)2)29-10-8-19(9-11-29)23(30)28-35(32,33)15-18-6-4-17(13-25)5-7-18/h4-7,12,19H,3,8-11,15H2,1-2H3,(H,28,30)