4-bromanyl-N-[3-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylpropyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[3-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylpropyl]benzenesulfonamide Openeye Name: 4-bromo-N-[3-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylpropyl]benzenesulfonamide CAS Name: 4-bromo-N-[3-[(1-ethyl-4,5-diphenyl-2-imidazolyl)thio]propyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[3-(1-ethyl-4,5-diphenylimidazol-2-yl)sulfanylpropyl]benzenesulfonamide Traditional Name: 4-bromo-N-[3-[(1-ethyl-4,5-diphenyl-imidazol-2-yl)thio]propyl]benzenesulfonamide Formula: C26H26BrN3O2S2 MolecularWeight: 556.53754

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCCCNS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=C(N=C1SCCCNS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H26BrN3O2S2/c1-2-30-25(21-12-7-4-8-13-21)24(20-10-5-3-6-11-20)29-26(30)33-19-9-18-28-34(31,32)23-16-14-22(27)15-17-23/h3-8,10-17,28H,2,9,18-19H2,1H3