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

Systemtic Name: propan-2-yl 5-cyano-2-methyl-6-[4-[(3-methylphenyl)methylsulfonylcarbamoyl]piperidin-1-yl]pyridine-3-carboxylate Openeye Name: isopropyl 5-cyano-2-methyl-6-[4-(m-tolylmethylsulfonylcarbamoyl)-1-piperidyl]pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[4-[[(3-methylphenyl)methylsulfonylamino]-oxomethyl]-1-piperidinyl]-3-pyridinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-cyano-2-methyl-6-[4-[(3-methylphenyl)methylsulfonylcarbamoyl]piperidin-1-yl]pyridine-3-carboxylate Traditional Name: 5-cyano-2-methyl-6-[4-[(3-methylbenzyl)sulfonylcarbamoyl]piperidino]nicotinic acid isopropyl ester Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)NC(=O)C2CCN(CC2)C3=NC(=C(C=C3C#N)C(=O)OC(C)C)C

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)NC(=O)C2CCN(CC2)C3=NC(=C(C=C3C#N)C(=O)OC(C)C)C

InChI

InChI=1S/C25H30N4O5S/c1-16(2)34-25(31)22-13-21(14-26)23(27-18(22)4)29-10-8-20(9-11-29)24(30)28-35(32,33)15-19-7-5-6-17(3)12-19/h5-7,12-13,16,20H,8-11,15H2,1-4H3,(H,28,30)