3-(2-cyclohexylsulfanylethyl)-4-ethyl-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-(2-cyclohexylsulfanylethyl)-4-ethyl-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-(2-cyclohexylsulfanylethyl)-4-ethyl-oxadiazol-3-ium-5-olate CAS Name: 3-[2-(cyclohexylthio)ethyl]-4-ethyl-5-oxadiazol-3-iumolate IUPAC Name: 3-(2-cyclohexylsulfanylethyl)-4-ethyloxadiazol-3-ium-5-olate Traditional Name: 3-[2-(cyclohexylthio)ethyl]-4-ethyl-oxadiazol-3-ium-5-olate Formula: C12H20N2O2S MolecularWeight: 256.3644

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(ON=[N+]1CCSC2CCCCC2)[O-]

Isomeric SMILES

CCC1=C(ON=[N+]1CCSC2CCCCC2)[O-]

InChI

InChI=1S/C12H20N2O2S/c1-2-11-12(15)16-13-14(11)8-9-17-10-6-4-3-5-7-10/h10H,2-9H2,1H3