2-methyl-5-nitro-3-(phenylmethyl)imidazole-4-thiolate

Systemtic Name: 2-methyl-5-nitro-3-(phenylmethyl)imidazole-4-thiolate Openeye Name: 3-benzyl-2-methyl-5-nitro-imidazole-4-thiolate CAS Name: 2-methyl-5-nitro-3-(phenylmethyl)-4-imidazolethiolate IUPAC Name: 3-benzyl-2-methyl-5-nitroimidazole-4-thiolate Traditional Name: 3-benzyl-2-methyl-5-nitro-imidazole-4-thiolate Formula: C11H10N3O2S- MolecularWeight: 248.281

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11N3O2S/c1-8-12-10(14(15)16)11(17)13(8)7-9-5-3-2-4-6-9/h2-6,17H,7H2,1H3/p-1