2-(pyridin-2-ylsulfanylmethyl)-3H-isoindol-1-one

Systemtic Name: 2-(pyridin-2-ylsulfanylmethyl)-3H-isoindol-1-one Openeye Name: 2-(2-pyridylsulfanylmethyl)isoindolin-1-one CAS Name: 2-[(2-pyridinylthio)methyl]-3H-isoindol-1-one IUPAC Name: 2-(pyridin-2-ylsulfanylmethyl)-3H-isoindol-1-one Traditional Name: 2-[(2-pyridylthio)methyl]isoindolin-1-one Formula: C14H12N2OS MolecularWeight: 256.32288

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N1CSC3=CC=CC=N3

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N1CSC3=CC=CC=N3

InChI

InChI=1S/C14H12N2OS/c17-14-12-6-2-1-5-11(12)9-16(14)10-18-13-7-3-4-8-15-13/h1-8H,9-10H2