N-[2-[4-[[(2R)-2-pyridin-3-ylpiperidin-1-ium-1-yl]methyl]phenoxy]ethyl]-1,3-thiazole-5-carboxamide

Systemtic Name: N-[2-[4-[[(2R)-2-pyridin-3-ylpiperidin-1-ium-1-yl]methyl]phenoxy]ethyl]-1,3-thiazole-5-carboxamide Openeye Name: N-[2-[4-[[(2R)-2-(3-pyridyl)piperidin-1-ium-1-yl]methyl]phenoxy]ethyl]thiazole-5-carboxamide CAS Name: N-[2-[4-[[(2R)-2-(3-pyridinyl)-1-piperidin-1-iumyl]methyl]phenoxy]ethyl]-5-thiazolecarboxamide IUPAC Name: N-[2-[4-[[(2R)-2-pyridin-3-ylpiperidin-1-ium-1-yl]methyl]phenoxy]ethyl]-1,3-thiazole-5-carboxamide Traditional Name: N-[2-[4-[[(2R)-2-(3-pyridyl)piperidin-1-ium-1-yl]methyl]phenoxy]ethyl]thiazole-5-carboxamide Formula: C23H27N4O2S+ MolecularWeight: 423.55108

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)C2=CN=CC=C2)CC3=CC=C(C=C3)OCCNC(=O)C4=CN=CS4

Isomeric SMILES

C1CC[NH+]([C@H](C1)C2=CN=CC=C2)CC3=CC=C(C=C3)OCCNC(=O)C4=CN=CS4

InChI

InChI=1S/C23H26N4O2S/c28-23(22-15-25-17-30-22)26-11-13-29-20-8-6-18(7-9-20)16-27-12-2-1-5-21(27)19-4-3-10-24-14-19/h3-4,6-10,14-15,17,21H,1-2,5,11-13,16H2,(H,26,28)/p+1/t21-/m1/s1