N,N-dimethyl-4-[[2-[(3-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]carbonyl]benzenesulfonamide

Systemtic Name: N,N-dimethyl-4-[[2-[(3-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]carbonyl]benzenesulfonamide Openeye Name: N,N-dimethyl-4-[2-[(3-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazole-1-carbonyl]benzenesulfonamide CAS Name: N,N-dimethyl-4-[[2-[(3-nitrophenyl)methylthio]-4,5-dihydroimidazol-1-yl]-oxomethyl]benzenesulfonamide IUPAC Name: N,N-dimethyl-4-[2-[(3-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazole-1-carbonyl]benzenesulfonamide Traditional Name: N,N-dimethyl-4-[2-[(3-nitrobenzyl)thio]-2-imidazoline-1-carbonyl]benzenesulfonamide Formula: C19H20N4O5S2 MolecularWeight: 448.5159

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN=C2SCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN=C2SCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O5S2/c1-21(2)30(27,28)17-8-6-15(7-9-17)18(24)22-11-10-20-19(22)29-13-14-4-3-5-16(12-14)23(25)26/h3-9,12H,10-11,13H2,1-2H3