1-(5-butanoyl-3-cyano-6-methoxy-pyridin-2-yl)-N-[(4-chlorophenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: 1-(5-butanoyl-3-cyano-6-methoxy-pyridin-2-yl)-N-[(4-chlorophenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: 1-(5-butanoyl-3-cyano-6-methoxy-2-pyridyl)-N-[(4-chlorophenyl)methylsulfonyl]piperidine-4-carboxamide CAS Name: N-[(4-chlorophenyl)methylsulfonyl]-1-[3-cyano-6-methoxy-5-(1-oxobutyl)-2-pyridinyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-butanoyl-3-cyano-6-methoxypyridin-2-yl)-N-[(4-chlorophenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: 1-(5-butyryl-3-cyano-6-methoxy-2-pyridyl)-N-(4-chlorobenzyl)sulfonyl-isonipecotamide Formula: C24H27ClN4O5S MolecularWeight: 519.01298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27ClN4O5S/c1-3-4-21(30)20-13-18(14-26)22(27-24(20)34-2)29-11-9-17(10-12-29)23(31)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,28,31)