N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]-3-bromanyl-benzamide

Systemtic Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]-3-bromanyl-benzamide Openeye Name: 3-bromo-N-[6-(diisobutylsulfamoyl)-1,3-benzothiazol-2-yl]benzamide CAS Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]-3-bromobenzamide IUPAC Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]-3-bromobenzamide Traditional Name: 3-bromo-N-[6-(diisobutylsulfamoyl)-1,3-benzothiazol-2-yl]benzamide Formula: C22H26BrN3O3S2 MolecularWeight: 524.49414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)CN(CC(C)C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C22H26BrN3O3S2/c1-14(2)12-26(13-15(3)4)31(28,29)18-8-9-19-20(11-18)30-22(24-19)25-21(27)16-6-5-7-17(23)10-16/h5-11,14-15H,12-13H2,1-4H3,(H,24,25,27)