2-[2-(2-oxidanylidenepropylsulfanyl)ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(2-oxidanylidenepropylsulfanyl)ethyl]isoindole-1,3-dione Openeye Name: 2-(2-acetonylsulfanylethyl)isoindoline-1,3-dione CAS Name: 2-[2-(2-oxopropylthio)ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(2-oxopropylsulfanyl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-(acetonylthio)ethyl]isoindoline-1,3-quinone Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSCCN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CC(=O)CSCCN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C13H13NO3S/c1-9(15)8-18-7-6-14-12(16)10-4-2-3-5-11(10)13(14)17/h2-5H,6-8H2,1H3