azanium 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoate

Systemtic Name: azanium 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoate Openeye Name: ammonium 2-(1-phenyltetrazol-5-yl)sulfanylacetate CAS Name: ammonium 2-[(1-phenyl-5-tetrazolyl)thio]acetate IUPAC Name: azanium 2-(1-phenyltetrazol-5-yl)sulfanylacetate Traditional Name: ammonium 2-[(1-phenyltetrazol-5-yl)thio]acetate Formula: C9H11N5O2S MolecularWeight: 253.28094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)[O-].[NH4+]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)[O-].[NH4+]

InChI

InChI=1S/C9H8N4O2S.H3N/c14-8(15)6-16-9-10-11-12-13(9)7-4-2-1-3-5-7;/h1-5H,6H2,(H,14,15);1H3