N-[3-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylpropyl]-2,4,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[3-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylpropyl]-2,4,6-trimethyl-benzenesulfonamide Openeye Name: N-[3-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylpropyl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-[3-[(1-butyl-4,5-diphenyl-2-imidazolyl)thio]propyl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-[3-(1-butyl-4,5-diphenylimidazol-2-yl)sulfanylpropyl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-[3-[(1-butyl-4,5-diphenyl-imidazol-2-yl)thio]propyl]-2,4,6-trimethyl-benzenesulfonamide Formula: C31H37N3O2S2 MolecularWeight: 547.77438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCCCNS(=O)(=O)C2=C(C=C(C=C2C)C)C)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=C(N=C1SCCCNS(=O)(=O)C2=C(C=C(C=C2C)C)C)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H37N3O2S2/c1-5-6-19-34-29(27-16-11-8-12-17-27)28(26-14-9-7-10-15-26)33-31(34)37-20-13-18-32-38(35,36)30-24(3)21-23(2)22-25(30)4/h7-12,14-17,21-22,32H,5-6,13,18-20H2,1-4H3