2-(3,5-dimethylphenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-(3,5-dimethylphenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-(3,5-dimethylphenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)thiazol-2-yl]acetamide CAS Name: 2-(3,5-dimethylphenoxy)-N-[4-(1-piperidin-1-iumylmethyl)-2-thiazolyl]acetamide IUPAC Name: 2-(3,5-dimethylphenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(3,5-dimethylphenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)thiazol-2-yl]acetamide Formula: C19H26N3O2S+ MolecularWeight: 360.49364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NC2=NC(=CS2)C[NH+]3CCCCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NC2=NC(=CS2)C[NH+]3CCCCC3)C

InChI

InChI=1S/C19H25N3O2S/c1-14-8-15(2)10-17(9-14)24-12-18(23)21-19-20-16(13-25-19)11-22-6-4-3-5-7-22/h8-10,13H,3-7,11-12H2,1-2H3,(H,20,21,23)/p+1