2-[(4-azanyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethylazanium

Systemtic Name: 2-[(4-azanyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethylazanium Openeye Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethylammonium CAS Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)thio]ethylammonium IUPAC Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethylazanium Traditional Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)thio]ethylammonium Formula: C7H16N5S+ MolecularWeight: 202.30044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1N)SCC[NH3+]

Isomeric SMILES

CCCC1=NN=C(N1N)SCC[NH3+]

InChI

InChI=1S/C7H15N5S/c1-2-3-6-10-11-7(12(6)9)13-5-4-8/h2-5,8-9H2,1H3/p+1