2-[(4-ethyl-5-pyridin-4-yl-1H-1,2,4-triazol-4-ium-3-yl)sulfanyl]-N-[4-(pyridin-2-ylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-[(4-ethyl-5-pyridin-4-yl-1H-1,2,4-triazol-4-ium-3-yl)sulfanyl]-N-[4-(pyridin-2-ylsulfamoyl)phenyl]ethanamide Openeye Name: 2-[[4-ethyl-5-(4-pyridyl)-1H-1,2,4-triazol-4-ium-3-yl]sulfanyl]-N-[4-(2-pyridylsulfamoyl)phenyl]acetamide CAS Name: 2-[(4-ethyl-5-pyridin-4-yl-1H-1,2,4-triazol-4-ium-3-yl)thio]-N-[4-(2-pyridinylsulfamoyl)phenyl]acetamide IUPAC Name: 2-[(4-ethyl-5-pyridin-4-yl-1H-1,2,4-triazol-4-ium-3-yl)sulfanyl]-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide Traditional Name: 2-[[4-ethyl-5-(4-pyridyl)-1H-1,2,4-triazol-4-ium-3-yl]thio]-N-[4-(2-pyridylsulfamoyl)phenyl]acetamide Formula: C22H22N7O3S2+ MolecularWeight: 496.58518

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(NN=C1SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3)C4=CC=NC=C4

Isomeric SMILES

CC[N+]1=C(NN=C1SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3)C4=CC=NC=C4

InChI

InChI=1S/C22H21N7O3S2/c1-2-29-21(16-10-13-23-14-11-16)26-27-22(29)33-15-20(30)25-17-6-8-18(9-7-17)34(31,32)28-19-5-3-4-12-24-19/h3-14H,2,15H2,1H3,(H2,24,25,28,30)/p+1