N-[4-bromanyl-2-[[(1-octylbenzimidazol-2-yl)amino]methyl]phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-bromanyl-2-[[(1-octylbenzimidazol-2-yl)amino]methyl]phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-bromo-2-[[(1-octylbenzimidazol-2-yl)amino]methyl]phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-bromo-2-[[(1-octyl-2-benzimidazolyl)amino]methyl]phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-bromo-2-[[(1-octylbenzimidazol-2-yl)amino]methyl]phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-bromo-2-[[(1-octylbenzimidazol-2-yl)amino]methyl]phenyl]-4-methyl-benzenesulfonamide Formula: C29H35BrN4O2S MolecularWeight: 583.5828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=CC=CC=C2N=C1NCC3=C(C=CC(=C3)Br)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCCCCCN1C2=CC=CC=C2N=C1NCC3=C(C=CC(=C3)Br)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C29H35BrN4O2S/c1-3-4-5-6-7-10-19-34-28-12-9-8-11-27(28)32-29(34)31-21-23-20-24(30)15-18-26(23)33-37(35,36)25-16-13-22(2)14-17-25/h8-9,11-18,20,33H,3-7,10,19,21H2,1-2H3,(H,31,32)