N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-6-(4-oxidanylpiperidin-1-yl)pyridin-1-ium-3-carboxamide

Systemtic Name: N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-6-(4-oxidanylpiperidin-1-yl)pyridin-1-ium-3-carboxamide Openeye Name: N-[(4-ethylthiazol-2-yl)methyl]-6-(4-hydroxy-1-piperidyl)pyridin-1-ium-3-carboxamide CAS Name: N-[(4-ethyl-2-thiazolyl)methyl]-6-(4-hydroxy-1-piperidinyl)-3-pyridin-1-iumcarboxamide IUPAC Name: N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-6-(4-hydroxypiperidin-1-yl)pyridin-1-ium-3-carboxamide Traditional Name: N-[(4-ethylthiazol-2-yl)methyl]-6-(4-hydroxypiperidino)pyridin-1-ium-3-carboxamide Formula: C17H23N4O2S+ MolecularWeight: 347.45512

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CSC(=N1)CNC(=O)C2=C[NH+]=C(C=C2)N3CCC(CC3)O

Isomeric SMILES

CCC1=CSC(=N1)CNC(=O)C2=C[NH+]=C(C=C2)N3CCC(CC3)O

InChI

InChI=1S/C17H22N4O2S/c1-2-13-11-24-16(20-13)10-19-17(23)12-3-4-15(18-9-12)21-7-5-14(22)6-8-21/h3-4,9,11,14,22H,2,5-8,10H2,1H3,(H,19,23)/p+1