2-[(6-azanyl-1,2,4,5-tetrazin-3-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(6-azanyl-1,2,4,5-tetrazin-3-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(6-amino-1,2,4,5-tetrazin-3-yl)sulfanyl]acetic acid CAS Name: 2-[(6-amino-1,2,4,5-tetrazin-3-yl)thio]acetic acid IUPAC Name: 2-[(6-amino-1,2,4,5-tetrazin-3-yl)sulfanyl]acetic acid Traditional Name: 2-[(6-amino-1,2,4,5-tetrazin-3-yl)thio]acetic acid Formula: C4H5N5O2S MolecularWeight: 187.1798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)O)SC1=NN=C(N=N1)N

Isomeric SMILES

C(C(=O)O)SC1=NN=C(N=N1)N

InChI

InChI=1S/C4H5N5O2S/c5-3-6-8-4(9-7-3)12-1-2(10)11/h1H2,(H,10,11)(H2,5,6,7)