4-(4-methylsulfanylphenyl)-1H-1,2,4-triazol-5-one

Systemtic Name: 4-(4-methylsulfanylphenyl)-1H-1,2,4-triazol-5-one Openeye Name: 4-(4-methylsulfanylphenyl)-1H-1,2,4-triazol-5-one CAS Name: 4-[4-(methylthio)phenyl]-1H-1,2,4-triazol-5-one IUPAC Name: 4-(4-methylsulfanylphenyl)-1H-1,2,4-triazol-5-one Traditional Name: 4-[4-(methylthio)phenyl]-1H-1,2,4-triazol-5-one Formula: C9H9N3OS MolecularWeight: 207.25226

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2C=NNC2=O

Isomeric SMILES

CSC1=CC=C(C=C1)N2C=NNC2=O

InChI

InChI=1S/C9H9N3OS/c1-14-8-4-2-7(3-5-8)12-6-10-11-9(12)13/h2-6H,1H3,(H,11,13)