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

Systemtic Name: 2-[3-(1-phenylimidazol-2-yl)sulfanylpropyl]isoindole-1,3-dione Openeye Name: 2-[3-(1-phenylimidazol-2-yl)sulfanylpropyl]isoindoline-1,3-dione CAS Name: 2-[3-[(1-phenyl-2-imidazolyl)thio]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(1-phenylimidazol-2-yl)sulfanylpropyl]isoindole-1,3-dione Traditional Name: 2-[3-[(1-phenylimidazol-2-yl)thio]propyl]isoindoline-1,3-quinone Formula: C20H17N3O2S MolecularWeight: 363.43288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=CN=C2SCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)N2C=CN=C2SCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H17N3O2S/c24-18-16-9-4-5-10-17(16)19(25)23(18)12-6-14-26-20-21-11-13-22(20)15-7-2-1-3-8-15/h1-5,7-11,13H,6,12,14H2