2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propylsulfanyl]-N-cyclooctyl-ethanamide

Systemtic Name: 2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propylsulfanyl]-N-cyclooctyl-ethanamide Openeye Name: N-cyclooctyl-2-[3-(1,3-dioxoisoindolin-2-yl)propylsulfanyl]acetamide CAS Name: N-cyclooctyl-2-[3-(1,3-dioxo-2-isoindolyl)propylthio]acetamide IUPAC Name: N-cyclooctyl-2-[3-(1,3-dioxoisoindol-2-yl)propylsulfanyl]acetamide Traditional Name: N-cyclooctyl-2-(3-phthalimidopropylthio)acetamide Formula: C21H28N2O3S MolecularWeight: 388.52362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CSCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CSCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H28N2O3S/c24-19(22-16-9-4-2-1-3-5-10-16)15-27-14-8-13-23-20(25)17-11-6-7-12-18(17)21(23)26/h6-7,11-12,16H,1-5,8-10,13-15H2,(H,22,24)