(5-nitropyridin-2-yl) carbamimidothioate

Systemtic Name: (5-nitropyridin-2-yl) carbamimidothioate Openeye Name: 2-(5-nitro-2-pyridyl)isothiourea CAS Name: carbamimidothioic acid (5-nitro-2-pyridinyl) ester IUPAC Name: (5-nitropyridin-2-yl) carbamimidothioate Traditional Name: 2-(5-nitro-2-pyridyl)isothiourea Formula: C6H6N4O2S MolecularWeight: 198.20244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1[N+](=O)[O-])SC(=N)N

Isomeric SMILES

C1=CC(=NC=C1[N+](=O)[O-])SC(=N)N

InChI

InChI=1S/C6H6N4O2S/c7-6(8)13-5-2-1-4(3-9-5)10(11)12/h1-3H,(H3,7,8)