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

Systemtic Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]-2-bromanyl-hexanamide Openeye Name: 2-bromo-N-[6-(diisobutylsulfamoyl)-1,3-benzothiazol-2-yl]hexanamide CAS Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]-2-bromohexanamide IUPAC Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]-2-bromohexanamide Traditional Name: 2-bromo-N-[6-(diisobutylsulfamoyl)-1,3-benzothiazol-2-yl]hexanamide Formula: C21H32BrN3O3S2 MolecularWeight: 518.53108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N(CC(C)C)CC(C)C)Br

Isomeric SMILES

CCCCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N(CC(C)C)CC(C)C)Br

InChI

InChI=1S/C21H32BrN3O3S2/c1-6-7-8-17(22)20(26)24-21-23-18-10-9-16(11-19(18)29-21)30(27,28)25(12-14(2)3)13-15(4)5/h9-11,14-15,17H,6-8,12-13H2,1-5H3,(H,23,24,26)