1-(5-butanoyl-3-cyano-6-methylsulfanyl-pyridin-2-yl)-N-[methyl(phenyl)sulfamoyl]piperidine-4-carboxamide

Systemtic Name: 1-(5-butanoyl-3-cyano-6-methylsulfanyl-pyridin-2-yl)-N-[methyl(phenyl)sulfamoyl]piperidine-4-carboxamide Openeye Name: 1-(5-butanoyl-3-cyano-6-methylsulfanyl-2-pyridyl)-N-[methyl(phenyl)sulfamoyl]piperidine-4-carboxamide CAS Name: 1-[3-cyano-6-(methylthio)-5-(1-oxobutyl)-2-pyridinyl]-N-[methyl(phenyl)sulfamoyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-butanoyl-3-cyano-6-methylsulfanylpyridin-2-yl)-N-[methyl(phenyl)sulfamoyl]piperidine-4-carboxamide Traditional Name: 1-[5-butyryl-3-cyano-6-(methylthio)-2-pyridyl]-N-[methyl(phenyl)sulfamoyl]isonipecotamide Formula: C24H29N5O4S2 MolecularWeight: 515.64816

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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)N(C)C3=CC=CC=C3)SC

Isomeric SMILES

CCCC(=O)C1=C(N=C(C(=C1)C#N)N2CCC(CC2)C(=O)NS(=O)(=O)N(C)C3=CC=CC=C3)SC

InChI

InChI=1S/C24H29N5O4S2/c1-4-8-21(30)20-15-18(16-25)22(26-24(20)34-3)29-13-11-17(12-14-29)23(31)27-35(32,33)28(2)19-9-6-5-7-10-19/h5-7,9-10,15,17H,4,8,11-14H2,1-3H3,(H,27,31)