5-(phenylcarbamothioylamino)-1H-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(phenylcarbamothioylamino)-1H-1,2,4-triazole-3-thiolate Openeye Name: 5-(phenylcarbamothioylamino)-1H-1,2,4-triazole-3-thiolate CAS Name: 5-[[anilino(sulfanylidene)methyl]amino]-1H-1,2,4-triazole-3-thiolate IUPAC Name: 5-(phenylcarbamothioylamino)-1H-1,2,4-triazole-3-thiolate Traditional Name: 5-(phenylthiocarbamoylamino)-1H-1,2,4-triazole-3-thiolate Formula: C9H8N5S2- MolecularWeight: 250.32332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=NC(=NN2)[S-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=NC(=NN2)[S-]

InChI

InChI=1S/C9H9N5S2/c15-8(10-6-4-2-1-3-5-6)11-7-12-9(16)14-13-7/h1-5H,(H4,10,11,12,13,14,15,16)/p-1