6,7-bis(methylsulfanyl)-2H-isoquinoline-3,5,8-trione

Systemtic Name: 6,7-bis(methylsulfanyl)-2H-isoquinoline-3,5,8-trione Openeye Name: 6,7-bis(methylsulfanyl)-2H-isoquinoline-3,5,8-trione CAS Name: 6,7-bis(methylthio)-2H-isoquinoline-3,5,8-trione IUPAC Name: 6,7-bis(methylsulfanyl)-2H-isoquinoline-3,5,8-trione Traditional Name: 6,7-bis(methylthio)-2H-isoquinoline-3,5,8-trione Formula: C11H9NO3S2 MolecularWeight: 267.32406

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)C2=CNC(=O)C=C2C1=O)SC

Isomeric SMILES

CSC1=C(C(=O)C2=CNC(=O)C=C2C1=O)SC

InChI

InChI=1S/C11H9NO3S2/c1-16-10-8(14)5-3-7(13)12-4-6(5)9(15)11(10)17-2/h3-4H,1-2H3,(H,12,13)