4-[[[5,7-bis(bromanyl)-6-oxidanyl-1,3-benzothiazol-2-yl]amino]methyl]benzenesulfonamide

Systemtic Name: 4-[[[5,7-bis(bromanyl)-6-oxidanyl-1,3-benzothiazol-2-yl]amino]methyl]benzenesulfonamide Openeye Name: 4-[[(5,7-dibromo-6-hydroxy-1,3-benzothiazol-2-yl)amino]methyl]benzenesulfonamide CAS Name: 4-[[(5,7-dibromo-6-hydroxy-1,3-benzothiazol-2-yl)amino]methyl]benzenesulfonamide IUPAC Name: 4-[[(5,7-dibromo-6-hydroxy-1,3-benzothiazol-2-yl)amino]methyl]benzenesulfonamide Traditional Name: 4-[[(5,7-dibromo-6-hydroxy-1,3-benzothiazol-2-yl)amino]methyl]benzenesulfonamide Formula: C14H11Br2N3O3S2 MolecularWeight: 493.19344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=NC3=CC(=C(C(=C3S2)Br)O)Br)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CNC2=NC3=CC(=C(C(=C3S2)Br)O)Br)S(=O)(=O)N

InChI

InChI=1S/C14H11Br2N3O3S2/c15-9-5-10-13(11(16)12(9)20)23-14(19-10)18-6-7-1-3-8(4-2-7)24(17,21)22/h1-5,20H,6H2,(H,18,19)(H2,17,21,22)