N-[2-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]naphthalene-2-sulfonamide

Systemtic Name: N-[2-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]naphthalene-2-sulfonamide Openeye Name: N-[2-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]naphthalene-2-sulfonamide CAS Name: N-[2-[(1-butyl-4,5-diphenyl-2-imidazolyl)thio]ethyl]-2-naphthalenesulfonamide IUPAC Name: N-[2-(1-butyl-4,5-diphenylimidazol-2-yl)sulfanylethyl]naphthalene-2-sulfonamide Traditional Name: N-[2-[(1-butyl-4,5-diphenyl-imidazol-2-yl)thio]ethyl]naphthalene-2-sulfonamide Formula: C31H31N3O2S2 MolecularWeight: 541.72674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCN1C(=C(N=C1SCCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H31N3O2S2/c1-2-3-21-34-30(26-15-8-5-9-16-26)29(25-13-6-4-7-14-25)33-31(34)37-22-20-32-38(35,36)28-19-18-24-12-10-11-17-27(24)23-28/h4-19,23,32H,2-3,20-22H2,1H3