2-[(2,4-dinitrophenyl)methylsulfanyl]-1-methyl-imidazole hydrochloride

Systemtic Name: 2-[(2,4-dinitrophenyl)methylsulfanyl]-1-methyl-imidazole hydrochloride Openeye Name: 2-[(2,4-dinitrophenyl)methylsulfanyl]-1-methyl-imidazole hydrochloride CAS Name: 2-[(2,4-dinitrophenyl)methylthio]-1-methylimidazole hydrochloride IUPAC Name: 2-[(2,4-dinitrophenyl)methylsulfanyl]-1-methylimidazole hydrochloride Traditional Name: 2-[(2,4-dinitrobenzyl)thio]-1-methyl-imidazole hydrochloride Formula: C11H11ClN4O4S MolecularWeight: 330.74744

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-].Cl

Isomeric SMILES

CN1C=CN=C1SCC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-].Cl

InChI

InChI=1S/C11H10N4O4S.ClH/c1-13-5-4-12-11(13)20-7-8-2-3-9(14(16)17)6-10(8)15(18)19;/h2-6H,7H2,1H3;1H