2,2-dimethyl-N-[2-[1-(1,3-thiazol-2-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]propanamide

Systemtic Name: 2,2-dimethyl-N-[2-[1-(1,3-thiazol-2-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]propanamide Openeye Name: 2,2-dimethyl-N-[2-[1-(thiazol-2-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]propanamide CAS Name: 2,2-dimethyl-N-[2-[1-(2-thiazolylmethyl)-4-piperidin-1-iumyl]-3-pyrazolyl]propanamide IUPAC Name: 2,2-dimethyl-N-[2-[1-(1,3-thiazol-2-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]propanamide Traditional Name: 2,2-dimethyl-N-[2-[1-(thiazol-2-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]propionamide Formula: C17H26N5OS+ MolecularWeight: 348.48624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=NN1C2CC[NH+](CC2)CC3=NC=CS3

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=NN1C2CC[NH+](CC2)CC3=NC=CS3

InChI

InChI=1S/C17H25N5OS/c1-17(2,3)16(23)20-14-4-7-19-22(14)13-5-9-21(10-6-13)12-15-18-8-11-24-15/h4,7-8,11,13H,5-6,9-10,12H2,1-3H3,(H,20,23)/p+1