2-[6-azanyl-3,5-dicyano-4-(4-methylphenyl)pyridin-1-ium-2-yl]sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-[6-azanyl-3,5-dicyano-4-(4-methylphenyl)pyridin-1-ium-2-yl]sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]ethanamide Openeye Name: 2-[6-amino-3,5-dicyano-4-(p-tolyl)pyridin-1-ium-2-yl]sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide CAS Name: 2-[[6-amino-3,5-dicyano-4-(4-methylphenyl)-2-pyridin-1-iumyl]thio]-N-[4-(2-pyrimidinylsulfamoyl)phenyl]acetamide IUPAC Name: 2-[6-amino-3,5-dicyano-4-(4-methylphenyl)pyridin-1-ium-2-yl]sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(p-tolyl)pyridin-1-ium-2-yl]thio]-N-[4-(2-pyrimidylsulfamoyl)phenyl]acetamide Formula: C26H21N8O3S2+ MolecularWeight: 557.62674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=[NH+]C(=C2C#N)SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=[NH+]C(=C2C#N)SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)N)C#N

InChI

InChI=1S/C26H20N8O3S2/c1-16-3-5-17(6-4-16)23-20(13-27)24(29)33-25(21(23)14-28)38-15-22(35)32-18-7-9-19(10-8-18)39(36,37)34-26-30-11-2-12-31-26/h2-12H,15H2,1H3,(H2,29,33)(H,32,35)(H,30,31,34)/p+1