3-[[5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]propylazanium

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O2S/c1-10-4-2-5-11(8-10)17-9-12-15-16-13(18-12)19-7-3-6-14/h2,4-5,8H,3,6-7,9,14H2,1H3/p+1