3-methylsulfanyl-N-(3-nitro-1H-1,2,4-triazol-5-yl)-1,2,4-triazin-5-amine

Systemtic Name: 3-methylsulfanyl-N-(3-nitro-1H-1,2,4-triazol-5-yl)-1,2,4-triazin-5-amine Openeye Name: 3-methylsulfanyl-N-(3-nitro-1H-1,2,4-triazol-5-yl)-1,2,4-triazin-5-amine CAS Name: 3-(methylthio)-N-(3-nitro-1H-1,2,4-triazol-5-yl)-1,2,4-triazin-5-amine IUPAC Name: 3-methylsulfanyl-N-(3-nitro-1H-1,2,4-triazol-5-yl)-1,2,4-triazin-5-amine Traditional Name: [3-(methylthio)-1,2,4-triazin-5-yl]-(3-nitro-1H-1,2,4-triazol-5-yl)amine Formula: C6H6N8O2S MolecularWeight: 254.22924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CN=N1)NC2=NC(=NN2)[N+](=O)[O-]

Isomeric SMILES

CSC1=NC(=CN=N1)NC2=NC(=NN2)[N+](=O)[O-]

InChI

InChI=1S/C6H6N8O2S/c1-17-6-9-3(2-7-13-6)8-4-10-5(12-11-4)14(15)16/h2H,1H3,(H2,8,9,10,11,12,13)