2-[3-nitro-5-(1H-1,2,4-triazol-5-ylsulfanyl)-1,2,4-triazol-1-yl]ethanamide

Systemtic Name: 2-[3-nitro-5-(1H-1,2,4-triazol-5-ylsulfanyl)-1,2,4-triazol-1-yl]ethanamide Openeye Name: 2-[3-nitro-5-(1H-1,2,4-triazol-5-ylsulfanyl)-1,2,4-triazol-1-yl]acetamide CAS Name: 2-[3-nitro-5-(1H-1,2,4-triazol-5-ylthio)-1,2,4-triazol-1-yl]acetamide IUPAC Name: 2-[3-nitro-5-(1H-1,2,4-triazol-5-ylsulfanyl)-1,2,4-triazol-1-yl]acetamide Traditional Name: 2-[3-nitro-5-(1H-1,2,4-triazol-5-ylthio)-1,2,4-triazol-1-yl]acetamide Formula: C6H6N8O3S MolecularWeight: 270.22864

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Descriptors Computed from Structure

Canonical SMILES:

C1=NNC(=N1)SC2=NC(=NN2CC(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=NNC(=N1)SC2=NC(=NN2CC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C6H6N8O3S/c7-3(15)1-13-6(10-4(12-13)14(16)17)18-5-8-2-9-11-5/h2H,1H2,(H2,7,15)(H,8,9,11)