[3-oxidanylidene-2-(phenylsulfanylmethyl)-1H-isoindol-1-yl] ethanoate

Systemtic Name: [3-oxidanylidene-2-(phenylsulfanylmethyl)-1H-isoindol-1-yl] ethanoate Openeye Name: [3-oxo-2-(phenylsulfanylmethyl)isoindolin-1-yl] acetate CAS Name: acetic acid [3-oxo-2-[(phenylthio)methyl]-1H-isoindol-1-yl] ester IUPAC Name: [3-oxo-2-(phenylsulfanylmethyl)-1H-isoindol-1-yl] acetate Traditional Name: acetic acid [3-keto-2-[(phenylthio)methyl]isoindolin-1-yl] ester Formula: C17H15NO3S MolecularWeight: 313.3709

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C2=CC=CC=C2C(=O)N1CSC3=CC=CC=C3

Isomeric SMILES

CC(=O)OC1C2=CC=CC=C2C(=O)N1CSC3=CC=CC=C3

InChI

InChI=1S/C17H15NO3S/c1-12(19)21-17-15-10-6-5-9-14(15)16(20)18(17)11-22-13-7-3-2-4-8-13/h2-10,17H,11H2,1H3