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

Systemtic Name: N-[4-bromanyl-2-[[(1-heptylbenzimidazol-2-yl)amino]methyl]phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-bromo-2-[[(1-heptylbenzimidazol-2-yl)amino]methyl]phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-bromo-2-[[(1-heptyl-2-benzimidazolyl)amino]methyl]phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-bromo-2-[[(1-heptylbenzimidazol-2-yl)amino]methyl]phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-bromo-2-[[(1-heptylbenzimidazol-2-yl)amino]methyl]phenyl]-4-methyl-benzenesulfonamide Formula: C28H33BrN4O2S MolecularWeight: 569.55622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C2=CC=CC=C2N=C1NCC3=C(C=CC(=C3)Br)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCCCCN1C2=CC=CC=C2N=C1NCC3=C(C=CC(=C3)Br)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C28H33BrN4O2S/c1-3-4-5-6-9-18-33-27-11-8-7-10-26(27)31-28(33)30-20-22-19-23(29)14-17-25(22)32-36(34,35)24-15-12-21(2)13-16-24/h7-8,10-17,19,32H,3-6,9,18,20H2,1-2H3,(H,30,31)