2-(6-azanyl-3,5-dicyano-4-thiophen-3-yl-pyridin-2-yl)sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]butanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-4-thiophen-3-yl-pyridin-2-yl)sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]butanamide Openeye Name: 2-[[6-amino-3,5-dicyano-4-(3-thienyl)-2-pyridyl]sulfanyl]-N-[4-(2-pyridylsulfamoyl)phenyl]butanamide CAS Name: 2-[[6-amino-3,5-dicyano-4-(3-thiophenyl)-2-pyridinyl]thio]-N-[4-(2-pyridinylsulfamoyl)phenyl]butanamide IUPAC Name: 2-(6-amino-3,5-dicyano-4-thiophen-3-ylpyridin-2-yl)sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]butanamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(3-thienyl)-2-pyridyl]thio]-N-[4-(2-pyridylsulfamoyl)phenyl]butyramide Formula: C26H21N7O3S3 MolecularWeight: 575.68504

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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(=C(C(=N3)N)C#N)C4=CSC=C4)C#N

Isomeric SMILES

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

InChI

InChI=1S/C26H21N7O3S3/c1-2-21(38-26-20(14-28)23(16-10-12-37-15-16)19(13-27)24(29)32-26)25(34)31-17-6-8-18(9-7-17)39(35,36)33-22-5-3-4-11-30-22/h3-12,15,21H,2H2,1H3,(H2,29,32)(H,30,33)(H,31,34)