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

Systemtic Name: 2-[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]butanamide Openeye Name: 2-[[3-cyano-6-(4-methoxyphenyl)-2-pyridyl]sulfanyl]-N-[4-(2-pyridylsulfamoyl)phenyl]butanamide CAS Name: 2-[[3-cyano-6-(4-methoxyphenyl)-2-pyridinyl]thio]-N-[4-(2-pyridinylsulfamoyl)phenyl]butanamide IUPAC Name: 2-[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]butanamide Traditional Name: 2-[[3-cyano-6-(4-methoxyphenyl)-2-pyridyl]thio]-N-[4-(2-pyridylsulfamoyl)phenyl]butyramide Formula: C28H25N5O4S2 MolecularWeight: 559.6592

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=N2)SC3=C(C=CC(=N3)C4=CC=C(C=C4)OC)C#N

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=N2)SC3=C(C=CC(=N3)C4=CC=C(C=C4)OC)C#N

InChI

InChI=1S/C28H25N5O4S2/c1-3-25(38-28-20(18-29)9-16-24(32-28)19-7-12-22(37-2)13-8-19)27(34)31-21-10-14-23(15-11-21)39(35,36)33-26-6-4-5-17-30-26/h4-17,25H,3H2,1-2H3,(H,30,33)(H,31,34)