2-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)isoindole-1,3-dione

Systemtic Name: 2-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)isoindole-1,3-dione Openeye Name: 2-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)isoindoline-1,3-dione CAS Name: 2-[3-(methylthio)-1H-1,2,4-triazol-5-yl]isoindole-1,3-dione IUPAC Name: 2-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)isoindole-1,3-dione Traditional Name: 2-[3-(methylthio)-1H-1,2,4-triazol-5-yl]isoindoline-1,3-quinone Formula: C11H8N4O2S MolecularWeight: 260.27182

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC(=N1)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CSC1=NNC(=N1)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C11H8N4O2S/c1-18-11-12-10(13-14-11)15-8(16)6-4-2-3-5-7(6)9(15)17/h2-5H,1H3,(H,12,13,14)