5-[tris(bromanyl)methylsulfonyl]-1H-1,2,4-triazole

Systemtic Name: 5-[tris(bromanyl)methylsulfonyl]-1H-1,2,4-triazole Openeye Name: 5-(tribromomethylsulfonyl)-1H-1,2,4-triazole CAS Name: 5-(tribromomethylsulfonyl)-1H-1,2,4-triazole IUPAC Name: 5-(tribromomethylsulfonyl)-1H-1,2,4-triazole Traditional Name: 5-(tribromomethylsulfonyl)-1H-1,2,4-triazole Formula: C3H2Br3N3O2S MolecularWeight: 383.84388

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Descriptors Computed from Structure

Canonical SMILES:

C1=NNC(=N1)S(=O)(=O)C(Br)(Br)Br

Isomeric SMILES

C1=NNC(=N1)S(=O)(=O)C(Br)(Br)Br

InChI

InChI=1S/C3H2Br3N3O2S/c4-3(5,6)12(10,11)2-7-1-8-9-2/h1H,(H,7,8,9)