1-ethyl-2-methyl-5-(4-methylphenyl)sulfanyl-4-nitro-imidazole

Systemtic Name: 1-ethyl-2-methyl-5-(4-methylphenyl)sulfanyl-4-nitro-imidazole Openeye Name: 1-ethyl-2-methyl-4-nitro-5-(p-tolylsulfanyl)imidazole CAS Name: 1-ethyl-2-methyl-5-[(4-methylphenyl)thio]-4-nitroimidazole IUPAC Name: 1-ethyl-2-methyl-5-(4-methylphenyl)sulfanyl-4-nitroimidazole Traditional Name: 1-ethyl-2-methyl-4-nitro-5-(p-tolylthio)imidazole Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC(=C1SC2=CC=C(C=C2)C)[N+](=O)[O-])C

Isomeric SMILES

CCN1C(=NC(=C1SC2=CC=C(C=C2)C)[N+](=O)[O-])C

InChI

InChI=1S/C13H15N3O2S/c1-4-15-10(3)14-12(16(17)18)13(15)19-11-7-5-9(2)6-8-11/h5-8H,4H2,1-3H3