2-[3-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)propyl]isoindole-1,3-dione hydrobromide

Systemtic Name: 2-[3-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)propyl]isoindole-1,3-dione hydrobromide Openeye Name: 2-[3-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)propyl]isoindoline-1,3-dione hydrobromide CAS Name: 2-[3-(4,5-dihydro-1H-imidazol-2-ylthio)propyl]isoindole-1,3-dione hydrobromide IUPAC Name: 2-[3-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)propyl]isoindole-1,3-dione hydrobromide Traditional Name: 2-[3-(2-imidazolin-2-ylthio)propyl]isoindoline-1,3-quinone hydrobromide Formula: C14H16BrN3O2S MolecularWeight: 370.26474

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)SCCCN2C(=O)C3=CC=CC=C3C2=O.Br

Isomeric SMILES

C1CN=C(N1)SCCCN2C(=O)C3=CC=CC=C3C2=O.Br

InChI

InChI=1S/C14H15N3O2S.BrH/c18-12-10-4-1-2-5-11(10)13(19)17(12)8-3-9-20-14-15-6-7-16-14;/h1-2,4-5H,3,6-9H2,(H,15,16);1H