2-[[2-(dimethylamino)-5-nitro-phenyl]methylsulfanyl]-4,4-dimethyl-1H-imidazole-5-thione

Systemtic Name: 2-[[2-(dimethylamino)-5-nitro-phenyl]methylsulfanyl]-4,4-dimethyl-1H-imidazole-5-thione Openeye Name: 2-[[2-(dimethylamino)-5-nitro-phenyl]methylsulfanyl]-4,4-dimethyl-1H-imidazole-5-thione CAS Name: 2-[[2-(dimethylamino)-5-nitrophenyl]methylthio]-4,4-dimethyl-1H-imidazole-5-thione IUPAC Name: 2-[[2-(dimethylamino)-5-nitrophenyl]methylsulfanyl]-4,4-dimethyl-1H-imidazole-5-thione Traditional Name: 2-[[2-(dimethylamino)-5-nitro-benzyl]thio]-5,5-dimethyl-2-imidazoline-4-thione Formula: C14H18N4O2S2 MolecularWeight: 338.44832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=S)NC(=N1)SCC2=C(C=CC(=C2)[N+](=O)[O-])N(C)C)C

Isomeric SMILES

CC1(C(=S)NC(=N1)SCC2=C(C=CC(=C2)[N+](=O)[O-])N(C)C)C

InChI

InChI=1S/C14H18N4O2S2/c1-14(2)12(21)15-13(16-14)22-8-9-7-10(18(19)20)5-6-11(9)17(3)4/h5-7H,8H2,1-4H3,(H,15,16,21)