methyl-(4-morpholin-4-ium-4-ylbutyl)-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium

Systemtic Name: methyl-(4-morpholin-4-ium-4-ylbutyl)-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium Openeye Name: methyl-(4-morpholin-4-ium-4-ylbutyl)-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium CAS Name: methyl-[4-(4-morpholin-4-iumyl)butyl]-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]ammonium IUPAC Name: methyl-(4-morpholin-4-ium-4-ylbutyl)-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium Traditional Name: methyl-(4-morpholin-4-ium-4-ylbutyl)-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium Formula: C16H26N4O2S+2 MolecularWeight: 338.46824

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCC[NH+]1CCOCC1)CC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

C[NH+](CCCC[NH+]1CCOCC1)CC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C16H24N4O2S/c1-19(6-2-3-7-20-8-10-21-11-9-20)13-15-17-16(18-22-15)14-5-4-12-23-14/h4-5,12H,2-3,6-11,13H2,1H3/p+2