3-(1-ethyl-1-methyl-5-nitro-3-sulfanidyl-imidazole-1,3-diium-2-yl)-6-methyl-pyridazine

Systemtic Name: 3-(1-ethyl-1-methyl-5-nitro-3-sulfanidyl-imidazole-1,3-diium-2-yl)-6-methyl-pyridazine Openeye Name: 3-(1-ethyl-1-methyl-5-nitro-3-sulfido-imidazole-1,3-diium-2-yl)-6-methyl-pyridazine CAS Name: 3-(1-ethyl-1-methyl-5-nitro-3-sulfido-2-imidazole-1,3-diiumyl)-6-methylpyridazine IUPAC Name: 3-(1-ethyl-1-methyl-5-nitro-3-sulfidoimidazole-1,3-diium-2-yl)-6-methylpyridazine Traditional Name: 3-(1-ethyl-1-methyl-5-nitro-3-sulfido-imidazole-1,3-diium-2-yl)-6-methyl-pyridazine Formula: C11H14N5O2S+ MolecularWeight: 280.32616

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C(=C[N+](=C1C2=NN=C(C=C2)C)[S-])[N+](=O)[O-])C

Isomeric SMILES

CC[N+]1(C(=C[N+](=C1C2=NN=C(C=C2)C)[S-])[N+](=O)[O-])C

InChI

InChI=1S/C11H14N5O2S/c1-4-16(3)10(15(17)18)7-14(19)11(16)9-6-5-8(2)12-13-9/h5-7H,4H2,1-3H3/q+1