2-[(1-methylimidazol-2-yl)sulfanylmethyl]isoindole-1,3-dione

Systemtic Name: 2-[(1-methylimidazol-2-yl)sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[(1-methylimidazol-2-yl)sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[(1-methyl-2-imidazolyl)thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[(1-methylimidazol-2-yl)sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[(1-methylimidazol-2-yl)thio]methyl]isoindoline-1,3-quinone Formula: C13H11N3O2S MolecularWeight: 273.31034

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CN1C=CN=C1SCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C13H11N3O2S/c1-15-7-6-14-13(15)19-8-16-11(17)9-4-2-3-5-10(9)12(16)18/h2-7H,8H2,1H3