2-(5-methylsulfanyl-4-oxidanylidene-pentyl)isoindole-1,3-dione

Systemtic Name: 2-(5-methylsulfanyl-4-oxidanylidene-pentyl)isoindole-1,3-dione Openeye Name: 2-(5-methylsulfanyl-4-oxo-pentyl)isoindoline-1,3-dione CAS Name: 2-[5-(methylthio)-4-oxopentyl]isoindole-1,3-dione IUPAC Name: 2-(5-methylsulfanyl-4-oxopentyl)isoindole-1,3-dione Traditional Name: 2-[4-keto-5-(methylthio)pentyl]isoindoline-1,3-quinone Formula: C14H15NO3S MolecularWeight: 277.3388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCC(=O)CCCN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CSCC(=O)CCCN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C14H15NO3S/c1-19-9-10(16)5-4-8-15-13(17)11-6-2-3-7-12(11)14(15)18/h2-3,6-7H,4-5,8-9H2,1H3