N-[3-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylpropyl]naphthalene-2-sulfonamide

Systemtic Name: N-[3-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylpropyl]naphthalene-2-sulfonamide Openeye Name: N-[3-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylpropyl]naphthalene-2-sulfonamide CAS Name: N-[3-[(1-butyl-4,5-diphenyl-2-imidazolyl)thio]propyl]-2-naphthalenesulfonamide IUPAC Name: N-[3-(1-butyl-4,5-diphenylimidazol-2-yl)sulfanylpropyl]naphthalene-2-sulfonamide Traditional Name: N-[3-[(1-butyl-4,5-diphenyl-imidazol-2-yl)thio]propyl]naphthalene-2-sulfonamide Formula: C32H33N3O2S2 MolecularWeight: 555.75332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCCCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCN1C(=C(N=C1SCCCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H33N3O2S2/c1-2-3-22-35-31(27-16-8-5-9-17-27)30(26-14-6-4-7-15-26)34-32(35)38-23-12-21-33-39(36,37)29-20-19-25-13-10-11-18-28(25)24-29/h4-11,13-20,24,33H,2-3,12,21-23H2,1H3