2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]ethanamide Openeye Name: 2-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]-N-[4-(2-pyridylsulfamoyl)phenyl]acetamide CAS Name: 2-[(6-butyl-3-cyano-2-pyridinyl)thio]-N-[4-(2-pyridinylsulfamoyl)phenyl]acetamide IUPAC Name: 2-(6-butyl-3-cyanopyridin-2-yl)sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide Traditional Name: 2-[(6-butyl-3-cyano-2-pyridyl)thio]-N-[4-(2-pyridylsulfamoyl)phenyl]acetamide Formula: C23H23N5O3S2 MolecularWeight: 481.59042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C=C1)C#N)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3

Isomeric SMILES

CCCCC1=NC(=C(C=C1)C#N)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3

InChI

InChI=1S/C23H23N5O3S2/c1-2-3-6-18-9-8-17(15-24)23(27-18)32-16-22(29)26-19-10-12-20(13-11-19)33(30,31)28-21-7-4-5-14-25-21/h4-5,7-14H,2-3,6,16H2,1H3,(H,25,28)(H,26,29)