3-[(4-methylsulfanylphenyl)methyl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-[(4-methylsulfanylphenyl)methyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-[(4-methylsulfanylphenyl)methyl]oxadiazol-3-ium-5-olate CAS Name: 3-[[4-(methylthio)phenyl]methyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-[(4-methylsulfanylphenyl)methyl]oxadiazol-3-ium-5-olate Traditional Name: 3-[4-(methylthio)benzyl]oxadiazol-3-ium-5-olate Formula: C10H10N2O2S MolecularWeight: 222.2636

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C[N+]2=NOC(=C2)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)C[N+]2=NOC(=C2)[O-]

InChI

InChI=1S/C10H10N2O2S/c1-15-9-4-2-8(3-5-9)6-12-7-10(13)14-11-12/h2-5,7H,6H2,1H3