1-[3-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)phenyl]ethanone

Systemtic Name: 1-[3-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)phenyl]ethanone Openeye Name: 1-[3-(5-thioxo-1H-1,2,4-triazol-4-yl)phenyl]ethanone CAS Name: 1-[3-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)phenyl]ethanone IUPAC Name: 1-[3-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)phenyl]ethanone Traditional Name: 1-[3-(5-thioxo-1H-1,2,4-triazol-4-yl)phenyl]ethanone Formula: C10H9N3OS MolecularWeight: 219.26296

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)N2C=NNC2=S

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)N2C=NNC2=S

InChI

InChI=1S/C10H9N3OS/c1-7(14)8-3-2-4-9(5-8)13-6-11-12-10(13)15/h2-6H,1H3,(H,12,15)