4-chloranyl-N-[2-(4,5-diphenyl-1-propyl-imidazol-2-yl)sulfanylethyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[2-(4,5-diphenyl-1-propyl-imidazol-2-yl)sulfanylethyl]-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-[2-(4,5-diphenyl-1-propyl-imidazol-2-yl)sulfanylethyl]-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[2-[(4,5-diphenyl-1-propyl-2-imidazolyl)thio]ethyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[2-(4,5-diphenyl-1-propylimidazol-2-yl)sulfanylethyl]-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-[2-[(4,5-diphenyl-1-propyl-imidazol-2-yl)thio]ethyl]-3-nitro-benzenesulfonamide Formula: C26H25ClN4O4S2 MolecularWeight: 557.0841

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(N=C1SCCNS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=C(N=C1SCCNS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H25ClN4O4S2/c1-2-16-30-25(20-11-7-4-8-12-20)24(19-9-5-3-6-10-19)29-26(30)36-17-15-28-37(34,35)21-13-14-22(27)23(18-21)31(32)33/h3-14,18,28H,2,15-17H2,1H3