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

Systemtic Name: 3-[3-cyano-6-(2-methylpropyl)pyridin-2-yl]sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide Openeye Name: 3-[(3-cyano-6-isobutyl-2-pyridyl)sulfanyl]-N-[4-(2-pyridylsulfamoyl)phenyl]propanamide CAS Name: 3-[[3-cyano-6-(2-methylpropyl)-2-pyridinyl]thio]-N-[4-(2-pyridinylsulfamoyl)phenyl]propanamide IUPAC Name: 3-[3-cyano-6-(2-methylpropyl)pyridin-2-yl]sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide Traditional Name: 3-[(3-cyano-6-isobutyl-2-pyridyl)thio]-N-[4-(2-pyridylsulfamoyl)phenyl]propionamide Formula: C24H25N5O3S2 MolecularWeight: 495.617

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3

Isomeric SMILES

CC(C)CC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3

InChI

InChI=1S/C24H25N5O3S2/c1-17(2)15-20-7-6-18(16-25)24(28-20)33-14-12-23(30)27-19-8-10-21(11-9-19)34(31,32)29-22-5-3-4-13-26-22/h3-11,13,17H,12,14-15H2,1-2H3,(H,26,29)(H,27,30)