4-[[(2S)-2-[2-(1H-imidazol-3-ium-3-yl)ethyl]piperidin-1-ium-1-yl]methyl]-5-methyl-2-thiophen-3-yl-1,3-oxazole

Systemtic Name: 4-[[(2S)-2-[2-(1H-imidazol-3-ium-3-yl)ethyl]piperidin-1-ium-1-yl]methyl]-5-methyl-2-thiophen-3-yl-1,3-oxazole Openeye Name: 4-[[(2S)-2-[2-(1H-imidazol-3-ium-3-yl)ethyl]piperidin-1-ium-1-yl]methyl]-5-methyl-2-(3-thienyl)oxazole CAS Name: 4-[[(2S)-2-[2-(1H-imidazol-3-ium-3-yl)ethyl]-1-piperidin-1-iumyl]methyl]-5-methyl-2-(3-thiophenyl)oxazole IUPAC Name: 4-[[(2S)-2-[2-(1H-imidazol-3-ium-3-yl)ethyl]piperidin-1-ium-1-yl]methyl]-5-methyl-2-thiophen-3-yl-1,3-oxazole Traditional Name: 4-[[(2S)-2-[2-(1H-imidazol-3-ium-3-yl)ethyl]piperidin-1-ium-1-yl]methyl]-5-methyl-2-(3-thienyl)oxazole Formula: C19H26N4OS+2 MolecularWeight: 358.50094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CSC=C2)C[NH+]3CCCCC3CC[N+]4=CNC=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CSC=C2)C[NH+]3CCCC[C@H]3CC[N+]4=CNC=C4

InChI

InChI=1S/C19H24N4OS/c1-15-18(21-19(24-15)16-6-11-25-13-16)12-23-8-3-2-4-17(23)5-9-22-10-7-20-14-22/h6-7,10-11,13-14,17H,2-5,8-9,12H2,1H3/p+2/t17-/m0/s1