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

Systemtic Name: N-(2,3-dimethylphenyl)-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]ethanamide Openeye Name: N-(2,3-dimethylphenyl)-N-[4-(piperidin-1-ium-1-ylmethyl)thiazol-2-yl]acetamide CAS Name: N-(2,3-dimethylphenyl)-N-[4-(1-piperidin-1-iumylmethyl)-2-thiazolyl]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]acetamide Traditional Name: N-(2,3-dimethylphenyl)-N-[4-(piperidin-1-ium-1-ylmethyl)thiazol-2-yl]acetamide Formula: C19H26N3OS+ MolecularWeight: 344.49424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N(C2=NC(=CS2)C[NH+]3CCCCC3)C(=O)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N(C2=NC(=CS2)C[NH+]3CCCCC3)C(=O)C)C

InChI

InChI=1S/C19H25N3OS/c1-14-8-7-9-18(15(14)2)22(16(3)23)19-20-17(13-24-19)12-21-10-5-4-6-11-21/h7-9,13H,4-6,10-12H2,1-3H3/p+1