5-[(2S)-1-methylpiperidin-1-ium-2-yl]-3-(thiophen-3-ylmethyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(2S)-1-methylpiperidin-1-ium-2-yl]-3-(thiophen-3-ylmethyl)-1,2,4-oxadiazole Openeye Name: 5-[(2S)-1-methylpiperidin-1-ium-2-yl]-3-(3-thienylmethyl)-1,2,4-oxadiazole CAS Name: 5-[(2S)-1-methyl-2-piperidin-1-iumyl]-3-(3-thiophenylmethyl)-1,2,4-oxadiazole IUPAC Name: 5-[(2S)-1-methylpiperidin-1-ium-2-yl]-3-(thiophen-3-ylmethyl)-1,2,4-oxadiazole Traditional Name: 5-[(2S)-1-methylpiperidin-1-ium-2-yl]-3-(3-thenyl)-1,2,4-oxadiazole Formula: C13H18N3OS+ MolecularWeight: 264.36652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCCC1C2=NC(=NO2)CC3=CSC=C3

Isomeric SMILES

C[NH+]1CCCC[C@H]1C2=NC(=NO2)CC3=CSC=C3

InChI

InChI=1S/C13H17N3OS/c1-16-6-3-2-4-11(16)13-14-12(15-17-13)8-10-5-7-18-9-10/h5,7,9,11H,2-4,6,8H2,1H3/p+1/t11-/m0/s1