2-(3-phenethylsulfanylpropyl)isoindole-1,3-dione

Systemtic Name: 2-(3-phenethylsulfanylpropyl)isoindole-1,3-dione Openeye Name: 2-(3-phenethylsulfanylpropyl)isoindoline-1,3-dione CAS Name: 2-[3-(phenethylthio)propyl]isoindole-1,3-dione IUPAC Name: 2-(3-phenethylsulfanylpropyl)isoindole-1,3-dione Traditional Name: 2-[3-(phenethylthio)propyl]isoindoline-1,3-quinone Formula: C19H19NO2S MolecularWeight: 325.42466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)CCSCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H19NO2S/c21-18-16-9-4-5-10-17(16)19(22)20(18)12-6-13-23-14-11-15-7-2-1-3-8-15/h1-5,7-10H,6,11-14H2