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

Systemtic Name: 3-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propylazanium Openeye Name: 3-[[5-(o-tolyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propylammonium CAS Name: 3-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]thio]propylammonium IUPAC Name: 3-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propylazanium Traditional Name: 3-[[5-(o-tolyl)-1,3,4-oxadiazol-2-yl]thio]propylammonium Formula: C12H16N3OS+ MolecularWeight: 250.33994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(O2)SCCC[NH3+]

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(O2)SCCC[NH3+]

InChI

InChI=1S/C12H15N3OS/c1-9-5-2-3-6-10(9)11-14-15-12(16-11)17-8-4-7-13/h2-3,5-6H,4,7-8,13H2,1H3/p+1