5-bromanyl-4-nitro-1-(2,4,6-trimethylphenyl)sulfonyl-imidazole

Systemtic Name: 5-bromanyl-4-nitro-1-(2,4,6-trimethylphenyl)sulfonyl-imidazole Openeye Name: 5-bromo-4-nitro-1-(2,4,6-trimethylphenyl)sulfonyl-imidazole CAS Name: 5-bromo-4-nitro-1-(2,4,6-trimethylphenyl)sulfonylimidazole IUPAC Name: 5-bromo-4-nitro-1-(2,4,6-trimethylphenyl)sulfonylimidazole Traditional Name: 5-bromo-1-mesitylsulfonyl-4-nitro-imidazole Formula: C12H12BrN3O4S MolecularWeight: 374.21038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C=NC(=C2Br)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C=NC(=C2Br)[N+](=O)[O-])C

InChI

InChI=1S/C12H12BrN3O4S/c1-7-4-8(2)10(9(3)5-7)21(19,20)15-6-14-12(11(15)13)16(17)18/h4-6H,1-3H3