S-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propyl] ethanethioate

Systemtic Name: S-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propyl] ethanethioate Openeye Name: S-[3-(1,3-dioxoisoindolin-2-yl)propyl] ethanethioate CAS Name: ethanethioic acid S-[3-(1,3-dioxo-2-isoindolyl)propyl] ester IUPAC Name: S-[3-(1,3-dioxoisoindol-2-yl)propyl] ethanethioate Traditional Name: ethanethioic acid S-(3-phthalimidopropyl) ester Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CC(=O)SCCCN1C(=O)C2=CC=CC=C2C1=O

InChI

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