2-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-1-methyl-imidazole

Systemtic Name: 2-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-1-methyl-imidazole Openeye Name: 2-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-1-methyl-imidazole CAS Name: 2-[[2,6-dinitro-4-(trifluoromethyl)phenyl]thio]-1-methylimidazole IUPAC Name: 2-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-1-methylimidazole Traditional Name: 2-[[2,6-dinitro-4-(trifluoromethyl)phenyl]thio]-1-methyl-imidazole Formula: C11H7F3N4O4S MolecularWeight: 348.25789

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1SC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C11H7F3N4O4S/c1-16-3-2-15-10(16)23-9-7(17(19)20)4-6(11(12,13)14)5-8(9)18(21)22/h2-5H,1H3