4-azanyl-3-(1,3-benzodioxol-5-yl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-azanyl-3-(1,3-benzodioxol-5-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-amino-3-(1,3-benzodioxol-5-yl)-1H-1,2,4-triazole-5-thione CAS Name: 4-amino-3-(1,3-benzodioxol-5-yl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-amino-3-(1,3-benzodioxol-5-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-amino-3-(1,3-benzodioxol-5-yl)-1H-1,2,4-triazole-5-thione Formula: C9H8N4O2S MolecularWeight: 236.25042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NNC(=S)N3N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NNC(=S)N3N

InChI

InChI=1S/C9H8N4O2S/c10-13-8(11-12-9(13)16)5-1-2-6-7(3-5)15-4-14-6/h1-3H,4,10H2,(H,12,16)