3-oxidanyl-3-(propylsulfanylmethyl)-2H-isoindol-1-one

Systemtic Name: 3-oxidanyl-3-(propylsulfanylmethyl)-2H-isoindol-1-one Openeye Name: 3-hydroxy-3-(propylsulfanylmethyl)isoindolin-1-one CAS Name: 3-hydroxy-3-[(propylthio)methyl]-2H-isoindol-1-one IUPAC Name: 3-hydroxy-3-(propylsulfanylmethyl)-2H-isoindol-1-one Traditional Name: 3-hydroxy-3-[(propylthio)methyl]isoindolin-1-one Formula: C12H15NO2S MolecularWeight: 237.318

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCC1(C2=CC=CC=C2C(=O)N1)O

Isomeric SMILES

CCCSCC1(C2=CC=CC=C2C(=O)N1)O

InChI

InChI=1S/C12H15NO2S/c1-2-7-16-8-12(15)10-6-4-3-5-9(10)11(14)13-12/h3-6,15H,2,7-8H2,1H3,(H,13,14)