N,N-dimethyl-2-[(4-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazole-1-sulfonamide

Systemtic Name: N,N-dimethyl-2-[(4-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazole-1-sulfonamide Openeye Name: N,N-dimethyl-2-[(4-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazole-1-sulfonamide CAS Name: N,N-dimethyl-2-[(4-nitrophenyl)methylthio]-4,5-dihydroimidazole-1-sulfonamide IUPAC Name: N,N-dimethyl-2-[(4-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazole-1-sulfonamide Traditional Name: N,N-dimethyl-2-[(4-nitrobenzyl)thio]-2-imidazoline-1-sulfonamide Formula: C12H16N4O4S2 MolecularWeight: 344.40984

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCN=C1SCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)N1CCN=C1SCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O4S2/c1-14(2)22(19,20)15-8-7-13-12(15)21-9-10-3-5-11(6-4-10)16(17)18/h3-6H,7-9H2,1-2H3