2-[2-(5-nitropyridin-2-yl)sulfanylethanoylamino]ethylazanium

Systemtic Name: 2-[2-(5-nitropyridin-2-yl)sulfanylethanoylamino]ethylazanium Openeye Name: 2-[[2-[(5-nitro-2-pyridyl)sulfanyl]acetyl]amino]ethylammonium CAS Name: 2-[[2-[(5-nitro-2-pyridinyl)thio]-1-oxoethyl]amino]ethylammonium IUPAC Name: 2-[[2-(5-nitropyridin-2-yl)sulfanylacetyl]amino]ethylazanium Traditional Name: 2-[[2-[(5-nitro-2-pyridyl)thio]acetyl]amino]ethylammonium Formula: C9H13N4O3S+ MolecularWeight: 257.28952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1[N+](=O)[O-])SCC(=O)NCC[NH3+]

Isomeric SMILES

C1=CC(=NC=C1[N+](=O)[O-])SCC(=O)NCC[NH3+]

InChI

InChI=1S/C9H12N4O3S/c10-3-4-11-8(14)6-17-9-2-1-7(5-12-9)13(15)16/h1-2,5H,3-4,6,10H2,(H,11,14)/p+1