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

Systemtic Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: 2-piperidin-1-ium-1-yl-N-[4-(p-tolyl)thiazol-2-yl]acetamide CAS Name: N-[4-(4-methylphenyl)-2-thiazolyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: 2-piperidin-1-ium-1-yl-N-[4-(p-tolyl)thiazol-2-yl]acetamide Formula: C17H22N3OS+ MolecularWeight: 316.44108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C[NH+]3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C[NH+]3CCCCC3

InChI

InChI=1S/C17H21N3OS/c1-13-5-7-14(8-6-13)15-12-22-17(18-15)19-16(21)11-20-9-3-2-4-10-20/h5-8,12H,2-4,9-11H2,1H3,(H,18,19,21)/p+1