6-(2-azanyl-5-nitro-phenyl)-3-sulfanylidene-2H-1,2,4-triazin-5-olate

Systemtic Name: 6-(2-azanyl-5-nitro-phenyl)-3-sulfanylidene-2H-1,2,4-triazin-5-olate Openeye Name: 6-(2-amino-5-nitro-phenyl)-3-thioxo-2H-1,2,4-triazin-5-olate CAS Name: 6-(2-amino-5-nitrophenyl)-3-sulfanylidene-2H-1,2,4-triazin-5-olate IUPAC Name: 6-(2-amino-5-nitrophenyl)-3-sulfanylidene-2H-1,2,4-triazin-5-olate Traditional Name: 6-(2-amino-5-nitro-phenyl)-3-thioxo-2H-1,2,4-triazin-5-olate Formula: C9H6N5O3S- MolecularWeight: 264.24064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C2=NNC(=S)N=C2[O-])N

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C2=NNC(=S)N=C2[O-])N

InChI

InChI=1S/C9H7N5O3S/c10-6-2-1-4(14(16)17)3-5(6)7-8(15)11-9(18)13-12-7/h1-3H,10H2,(H2,11,13,15,18)/p-1