4-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]-2-methyl-5-nitro-1H-imidazole

Systemtic Name: 4-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]-2-methyl-5-nitro-1H-imidazole Openeye Name: 4-[(3-bromo-4-methoxy-phenyl)methylsulfanyl]-2-methyl-5-nitro-1H-imidazole CAS Name: 4-[(3-bromo-4-methoxyphenyl)methylthio]-2-methyl-5-nitro-1H-imidazole IUPAC Name: 4-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-2-methyl-5-nitro-1H-imidazole Traditional Name: 4-[(3-bromo-4-methoxy-benzyl)thio]-2-methyl-5-nitro-1H-imidazole Formula: C12H12BrN3O3S MolecularWeight: 358.21098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12BrN3O3S/c1-7-14-11(16(17)18)12(15-7)20-6-8-3-4-10(19-2)9(13)5-8/h3-5H,6H2,1-2H3,(H,14,15)