1-methyl-2-(2,4,6-trinitrophenyl)sulfanyl-imidazole

Systemtic Name: 1-methyl-2-(2,4,6-trinitrophenyl)sulfanyl-imidazole Openeye Name: 1-methyl-2-(2,4,6-trinitrophenyl)sulfanyl-imidazole CAS Name: 1-methyl-2-[(2,4,6-trinitrophenyl)thio]imidazole IUPAC Name: 1-methyl-2-(2,4,6-trinitrophenyl)sulfanylimidazole Traditional Name: 1-methyl-2-(picrylthio)imidazole Formula: C10H7N5O6S MolecularWeight: 325.25748

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1SC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H7N5O6S/c1-12-3-2-11-10(12)22-9-7(14(18)19)4-6(13(16)17)5-8(9)15(20)21/h2-5H,1H3