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

Systemtic Name: 2-[(3S)-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-3-yl]-1,3-benzoxazole Openeye Name: 2-[(3S)-1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-3-yl]-1,3-benzoxazole CAS Name: 2-[(3S)-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-3-piperidin-1-iumyl]-1,3-benzoxazole IUPAC Name: 2-[(3S)-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-3-yl]-1,3-benzoxazole Traditional Name: 2-[(3S)-1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-3-yl]-1,3-benzoxazole Formula: C19H19N4O2S+ MolecularWeight: 367.44476

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=NC(=NO2)C3=CC=CS3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=NC(=NO2)C3=CC=CS3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C19H18N4O2S/c1-2-7-15-14(6-1)20-19(24-15)13-5-3-9-23(11-13)12-17-21-18(22-25-17)16-8-4-10-26-16/h1-2,4,6-8,10,13H,3,5,9,11-12H2/p+1/t13-/m0/s1