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

Systemtic Name: propan-2-yl 5-cyano-6-[4-[(4-methoxyphenyl)methylsulfonylcarbamoyl]piperidin-1-yl]-2-[(2-oxidanylidenepyrrolidin-1-yl)methyl]pyridine-3-carboxylate Openeye Name: isopropyl 5-cyano-6-[4-[(4-methoxyphenyl)methylsulfonylcarbamoyl]-1-piperidyl]-2-[(2-oxopyrrolidin-1-yl)methyl]pyridine-3-carboxylate CAS Name: 5-cyano-6-[4-[[(4-methoxyphenyl)methylsulfonylamino]-oxomethyl]-1-piperidinyl]-2-[(2-oxo-1-pyrrolidinyl)methyl]-3-pyridinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-cyano-6-[4-[(4-methoxyphenyl)methylsulfonylcarbamoyl]piperidin-1-yl]-2-[(2-oxopyrrolidin-1-yl)methyl]pyridine-3-carboxylate Traditional Name: 5-cyano-2-[(2-ketopyrrolidino)methyl]-6-[4-(p-anisylsulfonylcarbamoyl)piperidino]nicotinic acid isopropyl ester Formula: C29H35N5O7S MolecularWeight: 597.6825

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(N=C(C(=C1)C#N)N2CCC(CC2)C(=O)NS(=O)(=O)CC3=CC=C(C=C3)OC)CN4CCCC4=O

Isomeric SMILES

CC(C)OC(=O)C1=C(N=C(C(=C1)C#N)N2CCC(CC2)C(=O)NS(=O)(=O)CC3=CC=C(C=C3)OC)CN4CCCC4=O

InChI

InChI=1S/C29H35N5O7S/c1-19(2)41-29(37)24-15-22(16-30)27(31-25(24)17-34-12-4-5-26(34)35)33-13-10-21(11-14-33)28(36)32-42(38,39)18-20-6-8-23(40-3)9-7-20/h6-9,15,19,21H,4-5,10-14,17-18H2,1-3H3,(H,32,36)