2-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole

Systemtic Name: 2-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole Openeye Name: 2-(5-methyl-3-phenyl-isoxazol-4-yl)-5-[[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole CAS Name: 2-(5-methyl-3-phenyl-4-isoxazolyl)-5-[[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]methyl]-1,3,4-oxadiazole IUPAC Name: 2-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole Traditional Name: 2-(5-methyl-3-phenyl-isoxazol-4-yl)-5-[[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole Formula: C21H21N4O2S+ MolecularWeight: 393.48204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C3=NN=C(O3)C[NH+]4CCCC4C5=CC=CS5

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C3=NN=C(O3)C[NH+]4CCC[C@@H]4C5=CC=CS5

InChI

InChI=1S/C21H20N4O2S/c1-14-19(20(24-27-14)15-7-3-2-4-8-15)21-23-22-18(26-21)13-25-11-5-9-16(25)17-10-6-12-28-17/h2-4,6-8,10,12,16H,5,9,11,13H2,1H3/p+1/t16-/m1/s1