3-oxidanyl-2-(2-pyridin-4-ylsulfanylethyl)-3H-isoindol-1-one

Systemtic Name: 3-oxidanyl-2-(2-pyridin-4-ylsulfanylethyl)-3H-isoindol-1-one Openeye Name: 3-hydroxy-2-[2-(4-pyridylsulfanyl)ethyl]isoindolin-1-one CAS Name: 3-hydroxy-2-[2-(pyridin-4-ylthio)ethyl]-3H-isoindol-1-one IUPAC Name: 3-hydroxy-2-(2-pyridin-4-ylsulfanylethyl)-3H-isoindol-1-one Traditional Name: 3-hydroxy-2-[2-(4-pyridylthio)ethyl]isoindolin-1-one Formula: C15H14N2O2S MolecularWeight: 286.34886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(N(C2=O)CCSC3=CC=NC=C3)O

Isomeric SMILES

C1=CC=C2C(=C1)C(N(C2=O)CCSC3=CC=NC=C3)O

InChI

InChI=1S/C15H14N2O2S/c18-14-12-3-1-2-4-13(12)15(19)17(14)9-10-20-11-5-7-16-8-6-11/h1-8,14,18H,9-10H2