4-nitro-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]benzenesulfonamide

Systemtic Name: 4-nitro-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]benzenesulfonamide Openeye Name: 4-nitro-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]benzenesulfonamide CAS Name: 4-nitro-N-[4-[(1,4,5-triphenyl-2-imidazolyl)thio]butyl]benzenesulfonamide IUPAC Name: 4-nitro-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]benzenesulfonamide Traditional Name: 4-nitro-N-[4-[(1,4,5-triphenylimidazol-2-yl)thio]butyl]benzenesulfonamide Formula: C31H28N4O4S2 MolecularWeight: 584.70842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(C(=N2)SCCCCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(C(=N2)SCCCCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H28N4O4S2/c36-35(37)27-18-20-28(21-19-27)41(38,39)32-22-10-11-23-40-31-33-29(24-12-4-1-5-13-24)30(25-14-6-2-7-15-25)34(31)26-16-8-3-9-17-26/h1-9,12-21,32H,10-11,22-23H2