cyclopropyl-[(4-methoxyphenyl)methyl]-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium

Systemtic Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium Openeye Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium CAS Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]ammonium IUPAC Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium Traditional Name: cyclopropyl-p-anisyl-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium Formula: C18H20N3O2S+ MolecularWeight: 342.4353

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+](CC2=NC(=NO2)C3=CC=CS3)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+](CC2=NC(=NO2)C3=CC=CS3)C4CC4

InChI

InChI=1S/C18H19N3O2S/c1-22-15-8-4-13(5-9-15)11-21(14-6-7-14)12-17-19-18(20-23-17)16-3-2-10-24-16/h2-5,8-10,14H,6-7,11-12H2,1H3/p+1