(3-fluoranyl-4-methoxy-phenyl)methyl-[(1R)-1-(4-methyl-2-pyridin-4-yl-pyrimidin-5-yl)ethyl]azanium

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl-[(1R)-1-(4-methyl-2-pyridin-4-yl-pyrimidin-5-yl)ethyl]azanium Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl-[(1R)-1-[4-methyl-2-(4-pyridyl)pyrimidin-5-yl]ethyl]ammonium CAS Name: (3-fluoro-4-methoxyphenyl)methyl-[(1R)-1-(4-methyl-2-pyridin-4-yl-5-pyrimidinyl)ethyl]ammonium IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]azanium Traditional Name: (3-fluoro-4-methoxy-benzyl)-[(1R)-1-[4-methyl-2-(4-pyridyl)pyrimidin-5-yl]ethyl]ammonium Formula: C20H22FN4O+ MolecularWeight: 353.413283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)[NH2+]CC2=CC(=C(C=C2)OC)F)C3=CC=NC=C3

Isomeric SMILES

CC1=NC(=NC=C1[C@@H](C)[NH2+]CC2=CC(=C(C=C2)OC)F)C3=CC=NC=C3

InChI

InChI=1S/C20H21FN4O/c1-13(23-11-15-4-5-19(26-3)18(21)10-15)17-12-24-20(25-14(17)2)16-6-8-22-9-7-16/h4-10,12-13,23H,11H2,1-3H3/p+1/t13-/m1/s1