2-[1-(furan-2-ylmethyl)-1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-1-ium-2-yl]ethanamide

Systemtic Name: 2-[1-(furan-2-ylmethyl)-1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-1-ium-2-yl]ethanamide Openeye Name: 2-[1-(2-furylmethyl)-1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-1-ium-2-yl]acetamide CAS Name: 2-[1-(2-furanylmethyl)-1-[2-(1-imidazolyl)-4-pyrimidinyl]-2-piperidin-1-iumyl]acetamide IUPAC Name: 2-[1-(furan-2-ylmethyl)-1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-1-ium-2-yl]acetamide Traditional Name: 2-[1-(2-furfuryl)-1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-1-ium-2-yl]acetamide Formula: C19H23N6O2+ MolecularWeight: 367.42492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](C(C1)CC(=O)N)(CC2=CC=CO2)C3=NC(=NC=C3)N4C=CN=C4

Isomeric SMILES

C1CC[N+](C(C1)CC(=O)N)(CC2=CC=CO2)C3=NC(=NC=C3)N4C=CN=C4

InChI

InChI=1S/C19H22N6O2/c20-17(26)12-15-4-1-2-10-25(15,13-16-5-3-11-27-16)18-6-7-22-19(23-18)24-9-8-21-14-24/h3,5-9,11,14-15H,1-2,4,10,12-13H2,(H-,20,26)/p+1