1-methyl-4-nitro-5-(1-phenylimidazol-2-yl)sulfanyl-imidazole

Systemtic Name: 1-methyl-4-nitro-5-(1-phenylimidazol-2-yl)sulfanyl-imidazole Openeye Name: 1-methyl-4-nitro-5-(1-phenylimidazol-2-yl)sulfanyl-imidazole CAS Name: 1-methyl-4-nitro-5-[(1-phenyl-2-imidazolyl)thio]imidazole IUPAC Name: 1-methyl-4-nitro-5-(1-phenylimidazol-2-yl)sulfanylimidazole Traditional Name: 1-methyl-4-nitro-5-[(1-phenylimidazol-2-yl)thio]imidazole Formula: C13H11N5O2S MolecularWeight: 301.32374

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1SC2=NC=CN2C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1SC2=NC=CN2C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H11N5O2S/c1-16-9-15-11(18(19)20)12(16)21-13-14-7-8-17(13)10-5-3-2-4-6-10/h2-9H,1H3