6-chloranyl-5-(dioxidanylmethyl)-2-[tris(bromanyl)methylsulfonyl]-1,3-benzothiazole

Systemtic Name: 6-chloranyl-5-(dioxidanylmethyl)-2-[tris(bromanyl)methylsulfonyl]-1,3-benzothiazole Openeye Name: 6-chloro-5-(hydroperoxymethyl)-2-(tribromomethylsulfonyl)-1,3-benzothiazole CAS Name: 6-chloro-5-(hydroperoxymethyl)-2-(tribromomethylsulfonyl)-1,3-benzothiazole IUPAC Name: 6-chloro-5-(hydroperoxymethyl)-2-(tribromomethylsulfonyl)-1,3-benzothiazole Traditional Name: 6-chloro-5-(hydroperoxymethyl)-2-(tribromomethylsulfonyl)-1,3-benzothiazole Formula: C9H5Br3ClNO4S2 MolecularWeight: 530.4353

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC2=C1N=C(S2)S(=O)(=O)C(Br)(Br)Br)Cl)COO

Isomeric SMILES

C1=C(C(=CC2=C1N=C(S2)S(=O)(=O)C(Br)(Br)Br)Cl)COO

InChI

InChI=1S/C9H5Br3ClNO4S2/c10-9(11,12)20(16,17)8-14-6-1-4(3-18-15)5(13)2-7(6)19-8/h1-2,15H,3H2