2-methyl-4-nitro-1-(phenylmethyl)-5-(phenylmethylsulfanyl)imidazole

Systemtic Name: 2-methyl-4-nitro-1-(phenylmethyl)-5-(phenylmethylsulfanyl)imidazole Openeye Name: 1-benzyl-5-benzylsulfanyl-2-methyl-4-nitro-imidazole CAS Name: 2-methyl-4-nitro-1-(phenylmethyl)-5-(phenylmethylthio)imidazole IUPAC Name: 1-benzyl-5-benzylsulfanyl-2-methyl-4-nitroimidazole Traditional Name: 1-benzyl-5-(benzylthio)-2-methyl-4-nitro-imidazole Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1CC2=CC=CC=C2)SCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(N1CC2=CC=CC=C2)SCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O2S/c1-14-19-17(21(22)23)18(24-13-16-10-6-3-7-11-16)20(14)12-15-8-4-2-5-9-15/h2-11H,12-13H2,1H3