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

Systemtic Name: 5-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)isoindole-1,3-dione Openeye Name: 5-(5-thioxo-1H-1,2,4-triazol-4-yl)isoindoline-1,3-dione CAS Name: 5-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)isoindole-1,3-dione IUPAC Name: 5-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)isoindole-1,3-dione Traditional Name: 5-(5-thioxo-1H-1,2,4-triazol-4-yl)isoindoline-1,3-quinone Formula: C10H6N4O2S MolecularWeight: 246.24524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N3C=NNC3=S)C(=O)NC2=O

Isomeric SMILES

C1=CC2=C(C=C1N3C=NNC3=S)C(=O)NC2=O

InChI

InChI=1S/C10H6N4O2S/c15-8-6-2-1-5(3-7(6)9(16)12-8)14-4-11-13-10(14)17/h1-4H,(H,13,17)(H,12,15,16)