2-[[4-azanyl-5-(1H-indazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[4-azanyl-5-(1H-indazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[4-amino-5-(1H-indazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-amino-5-(1H-indazol-3-yl)-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[4-amino-5-(1H-indazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-amino-5-(1H-indazol-3-yl)-1,2,4-triazol-3-yl]thio]acetate Formula: C11H9N6O2S- MolecularWeight: 289.29316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN2)C3=NN=C(N3N)SCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN2)C3=NN=C(N3N)SCC(=O)[O-]

InChI

InChI=1S/C11H10N6O2S/c12-17-10(15-16-11(17)20-5-8(18)19)9-6-3-1-2-4-7(6)13-14-9/h1-4H,5,12H2,(H,13,14)(H,18,19)/p-1