N-[4-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]-3-methyl-benzamide

Systemtic Name: N-[4-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]-3-methyl-benzamide Openeye Name: N-[4-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]thiazol-2-yl]-3-methyl-benzamide CAS Name: N-[4-[[(3S,5S)-3,5-dimethyl-1-piperidin-1-iumyl]methyl]-2-thiazolyl]-3-methylbenzamide IUPAC Name: N-[4-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]-3-methylbenzamide Traditional Name: N-[4-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]thiazol-2-yl]-3-methyl-benzamide Formula: C19H26N3OS+ MolecularWeight: 344.49424

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC2=CSC(=N2)NC(=O)C3=CC(=CC=C3)C)C

Isomeric SMILES

C[C@H]1C[C@@H](C[NH+](C1)CC2=CSC(=N2)NC(=O)C3=CC(=CC=C3)C)C

InChI

InChI=1S/C19H25N3OS/c1-13-5-4-6-16(8-13)18(23)21-19-20-17(12-24-19)11-22-9-14(2)7-15(3)10-22/h4-6,8,12,14-15H,7,9-11H2,1-3H3,(H,20,21,23)/p+1/t14-,15-/m0/s1