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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCCCCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCN1C(=C(N=C1SCCCCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H31N3O2S2/c1-2-34-30(26-16-7-4-8-17-26)29(25-14-5-3-6-15-25)33-31(34)37-22-12-11-21-32-38(35,36)28-20-19-24-13-9-10-18-27(24)23-28/h3-10,13-20,23,32H,2,11-12,21-22H2,1H3