(3S)-1-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]-N-phenyl-piperidin-1-ium-3-amine

Systemtic Name: (3S)-1-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]-N-phenyl-piperidin-1-ium-3-amine Openeye Name: (3S)-1-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methyl]-N-phenyl-piperidin-1-ium-3-amine CAS Name: (3S)-1-[(5-methyl-2-thiophen-2-yl-4-oxazolyl)methyl]-N-phenyl-3-piperidin-1-iumamine IUPAC Name: (3S)-1-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]-N-phenylpiperidin-1-ium-3-amine Traditional Name: [(3S)-1-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-phenyl-amine Formula: C20H24N3OS+ MolecularWeight: 354.48906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CS2)C[NH+]3CCCC(C3)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CS2)C[NH+]3CCC[C@@H](C3)NC4=CC=CC=C4

InChI

InChI=1S/C20H23N3OS/c1-15-18(22-20(24-15)19-10-6-12-25-19)14-23-11-5-9-17(13-23)21-16-7-3-2-4-8-16/h2-4,6-8,10,12,17,21H,5,9,11,13-14H2,1H3/p+1/t17-/m0/s1