N-[2-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-[(1-ethyl-4,5-diphenyl-2-imidazolyl)thio]ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-(1-ethyl-4,5-diphenylimidazol-2-yl)sulfanylethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-[(1-ethyl-4,5-diphenyl-imidazol-2-yl)thio]ethyl]-4-nitro-benzenesulfonamide Formula: C25H24N4O4S2 MolecularWeight: 508.61246

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=C(N=C1SCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4O4S2/c1-2-28-24(20-11-7-4-8-12-20)23(19-9-5-3-6-10-19)27-25(28)34-18-17-26-35(32,33)22-15-13-21(14-16-22)29(30)31/h3-16,26H,2,17-18H2,1H3