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

Systemtic Name: 3-(4-propan-2-ylphenyl)-5-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-(4-isopropylphenyl)-5-[[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(4-propan-2-ylphenyl)-5-[[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-propan-2-ylphenyl)-5-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-p-cumenyl-5-[[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Formula: C20H24N3OS+ MolecularWeight: 354.48906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCCC3C4=CC=CS4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCC[C@@H]3C4=CC=CS4

InChI

InChI=1S/C20H23N3OS/c1-14(2)15-7-9-16(10-8-15)20-21-19(24-22-20)13-23-11-3-5-17(23)18-6-4-12-25-18/h4,6-10,12,14,17H,3,5,11,13H2,1-2H3/p+1/t17-/m1/s1