[(3S)-1-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-3-yl]-thiophen-2-yl-methanone

Systemtic Name: [(3S)-1-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-3-yl]-thiophen-2-yl-methanone Openeye Name: [(3S)-1-[[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-3-yl]-(2-thienyl)methanone CAS Name: [(3S)-1-[[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]methyl]-3-piperidin-1-iumyl]-thiophen-2-ylmethanone IUPAC Name: [(3S)-1-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-3-yl]-thiophen-2-ylmethanone Traditional Name: [(3S)-1-[[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-3-yl]-(2-thienyl)methanone Formula: C18H19N4O2S+ MolecularWeight: 355.43406

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=NC(=NO2)C3=CC=CC=N3)C(=O)C4=CC=CS4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=NC(=NO2)C3=CC=CC=N3)C(=O)C4=CC=CS4

InChI

InChI=1S/C18H18N4O2S/c23-17(15-7-4-10-25-15)13-5-3-9-22(11-13)12-16-20-18(21-24-16)14-6-1-2-8-19-14/h1-2,4,6-8,10,13H,3,5,9,11-12H2/p+1/t13-/m0/s1