N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-[4-(2-pyrimidinylsulfamoyl)phenyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-[4-(2-pyrimidylsulfamoyl)phenyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C14H13N7O3S2 MolecularWeight: 391.42812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=NN3

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=NN3

InChI

InChI=1S/C14H13N7O3S2/c22-12(8-25-14-17-9-18-20-14)19-10-2-4-11(5-3-10)26(23,24)21-13-15-6-1-7-16-13/h1-7,9H,8H2,(H,19,22)(H,15,16,21)(H,17,18,20)