(5-methylfuran-2-yl)methyl-[(2-propylpyrimidin-5-yl)methyl]-(pyridin-2-ylmethyl)azanium

Systemtic Name: (5-methylfuran-2-yl)methyl-[(2-propylpyrimidin-5-yl)methyl]-(pyridin-2-ylmethyl)azanium Openeye Name: (5-methyl-2-furyl)methyl-[(2-propylpyrimidin-5-yl)methyl]-(2-pyridylmethyl)ammonium CAS Name: (5-methyl-2-furanyl)methyl-[(2-propyl-5-pyrimidinyl)methyl]-(2-pyridinylmethyl)ammonium IUPAC Name: (5-methylfuran-2-yl)methyl-[(2-propylpyrimidin-5-yl)methyl]-(pyridin-2-ylmethyl)azanium Traditional Name: (5-methyl-2-furyl)methyl-[(2-propylpyrimidin-5-yl)methyl]-(2-pyridylmethyl)ammonium Formula: C20H25N4O+ MolecularWeight: 337.4387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC=C(C=N1)C[NH+](CC2=CC=CC=N2)CC3=CC=C(O3)C

Isomeric SMILES

CCCC1=NC=C(C=N1)C[NH+](CC2=CC=CC=N2)CC3=CC=C(O3)C

InChI

InChI=1S/C20H24N4O/c1-3-6-20-22-11-17(12-23-20)13-24(14-18-7-4-5-10-21-18)15-19-9-8-16(2)25-19/h4-5,7-12H,3,6,13-15H2,1-2H3/p+1