2-[[5-[(3,5-dimethylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethylazanium

Systemtic Name: 2-[[5-[(3,5-dimethylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethylazanium Openeye Name: 2-[[5-[(3,5-dimethylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethylammonium CAS Name: 2-[[5-[(3,5-dimethylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]ethylammonium IUPAC Name: 2-[[5-[(3,5-dimethylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethylazanium Traditional Name: 2-[[5-[(3,5-dimethylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]ethylammonium Formula: C13H18N3O2S+ MolecularWeight: 280.36592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC2=NN=C(O2)SCC[NH3+])C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC2=NN=C(O2)SCC[NH3+])C

InChI

InChI=1S/C13H17N3O2S/c1-9-5-10(2)7-11(6-9)17-8-12-15-16-13(18-12)19-4-3-14/h5-7H,3-4,8,14H2,1-2H3/p+1