2-ethoxy-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]pyridine-3-carboxamide

Systemtic Name: 2-ethoxy-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]pyridine-3-carboxamide Openeye Name: 2-ethoxy-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]thiazol-2-yl]pyridine-3-carboxamide CAS Name: 2-ethoxy-N-[4-[(4-methyl-1-piperidin-1-iumyl)methyl]-2-thiazolyl]-3-pyridinecarboxamide IUPAC Name: 2-ethoxy-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]pyridine-3-carboxamide Traditional Name: 2-ethoxy-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]thiazol-2-yl]nicotinamide Formula: C18H25N4O2S+ MolecularWeight: 361.4817

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)NC2=NC(=CS2)C[NH+]3CCC(CC3)C

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)NC2=NC(=CS2)C[NH+]3CCC(CC3)C

InChI

InChI=1S/C18H24N4O2S/c1-3-24-17-15(5-4-8-19-17)16(23)21-18-20-14(12-25-18)11-22-9-6-13(2)7-10-22/h4-5,8,12-13H,3,6-7,9-11H2,1-2H3,(H,20,21,23)/p+1