5-methyl-2-(5-methylthiophen-2-yl)-4-[[(2S)-2-(2-pyridin-2-ylethyl)piperidin-1-ium-1-yl]methyl]-1,3-oxazole

Systemtic Name: 5-methyl-2-(5-methylthiophen-2-yl)-4-[[(2S)-2-(2-pyridin-2-ylethyl)piperidin-1-ium-1-yl]methyl]-1,3-oxazole Openeye Name: 5-methyl-2-(5-methyl-2-thienyl)-4-[[(2S)-2-[2-(2-pyridyl)ethyl]piperidin-1-ium-1-yl]methyl]oxazole CAS Name: 5-methyl-2-(5-methyl-2-thiophenyl)-4-[[(2S)-2-[2-(2-pyridinyl)ethyl]-1-piperidin-1-iumyl]methyl]oxazole IUPAC Name: 5-methyl-2-(5-methylthiophen-2-yl)-4-[[(2S)-2-(2-pyridin-2-ylethyl)piperidin-1-ium-1-yl]methyl]-1,3-oxazole Traditional Name: 5-methyl-2-(5-methyl-2-thienyl)-4-[[(2S)-2-[2-(2-pyridyl)ethyl]piperidin-1-ium-1-yl]methyl]oxazole Formula: C22H28N3OS+ MolecularWeight: 382.54222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=NC(=C(O2)C)C[NH+]3CCCCC3CCC4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(S1)C2=NC(=C(O2)C)C[NH+]3CCCC[C@H]3CCC4=CC=CC=N4

InChI

InChI=1S/C22H27N3OS/c1-16-9-12-21(27-16)22-24-20(17(2)26-22)15-25-14-6-4-8-19(25)11-10-18-7-3-5-13-23-18/h3,5,7,9,12-13,19H,4,6,8,10-11,14-15H2,1-2H3/p+1/t19-/m0/s1