2-[3-(1-methylbenzimidazol-2-yl)sulfanylpropyl]isoindole-1,3-dione

Systemtic Name: 2-[3-(1-methylbenzimidazol-2-yl)sulfanylpropyl]isoindole-1,3-dione Openeye Name: 2-[3-(1-methylbenzimidazol-2-yl)sulfanylpropyl]isoindoline-1,3-dione CAS Name: 2-[3-[(1-methyl-2-benzimidazolyl)thio]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(1-methylbenzimidazol-2-yl)sulfanylpropyl]isoindole-1,3-dione Traditional Name: 2-[3-[(1-methylbenzimidazol-2-yl)thio]propyl]isoindoline-1,3-quinone Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C19H17N3O2S/c1-21-16-10-5-4-9-15(16)20-19(21)25-12-6-11-22-17(23)13-7-2-3-8-14(13)18(22)24/h2-5,7-10H,6,11-12H2,1H3