2-(pyridin-3-ylsulfanylmethyl)isoindole-1,3-dione

Systemtic Name: 2-(pyridin-3-ylsulfanylmethyl)isoindole-1,3-dione Openeye Name: 2-(3-pyridylsulfanylmethyl)isoindoline-1,3-dione CAS Name: 2-[(3-pyridinylthio)methyl]isoindole-1,3-dione IUPAC Name: 2-(pyridin-3-ylsulfanylmethyl)isoindole-1,3-dione Traditional Name: 2-[(3-pyridylthio)methyl]isoindoline-1,3-quinone Formula: C14H10N2O2S MolecularWeight: 270.3064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CSC3=CN=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CSC3=CN=CC=C3

InChI

InChI=1S/C14H10N2O2S/c17-13-11-5-1-2-6-12(11)14(18)16(13)9-19-10-4-3-7-15-8-10/h1-8H,9H2