4-tert-butyl-N-[4-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylbutyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[4-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylbutyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[4-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylbutyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[4-[(1-ethyl-4,5-diphenyl-2-imidazolyl)thio]butyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[4-(1-ethyl-4,5-diphenylimidazol-2-yl)sulfanylbutyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[4-[(1-ethyl-4,5-diphenyl-imidazol-2-yl)thio]butyl]benzenesulfonamide Formula: C31H37N3O2S2 MolecularWeight: 547.77438

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCCCCNS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=C(N=C1SCCCCNS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H37N3O2S2/c1-5-34-29(25-16-10-7-11-17-25)28(24-14-8-6-9-15-24)33-30(34)37-23-13-12-22-32-38(35,36)27-20-18-26(19-21-27)31(2,3)4/h6-11,14-21,32H,5,12-13,22-23H2,1-4H3