3-[5-[(3-chlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]propylazanium

Systemtic Name: 3-[5-[(3-chlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]propylazanium Openeye Name: 3-[5-[(3-chlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]propylammonium CAS Name: 3-[5-[(3-chlorophenyl)methylthio]-1,3,4-oxadiazol-2-yl]propylammonium IUPAC Name: 3-[5-[(3-chlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]propylazanium Traditional Name: 3-[5-[(3-chlorobenzyl)thio]-1,3,4-oxadiazol-2-yl]propylammonium Formula: C12H15ClN3OS+ MolecularWeight: 284.785

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CSC2=NN=C(O2)CCC[NH3+]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CSC2=NN=C(O2)CCC[NH3+]

InChI

InChI=1S/C12H14ClN3OS/c13-10-4-1-3-9(7-10)8-18-12-16-15-11(17-12)5-2-6-14/h1,3-4,7H,2,5-6,8,14H2/p+1