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

Systemtic Name: 3-[[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]propylazanium Openeye Name: 3-[[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]propylammonium CAS Name: 3-[[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-oxadiazol-2-yl]thio]propylammonium IUPAC Name: 3-[[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]propylazanium Traditional Name: 3-[(5-veratryl-1,3,4-oxadiazol-2-yl)thio]propylammonium Formula: C14H20N3O3S+ MolecularWeight: 310.3919

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NN=C(O2)SCCC[NH3+])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NN=C(O2)SCCC[NH3+])OC

InChI

InChI=1S/C14H19N3O3S/c1-18-11-5-4-10(8-12(11)19-2)9-13-16-17-14(20-13)21-7-3-6-15/h4-5,8H,3,6-7,9,15H2,1-2H3/p+1