4-[1-[(2,5-dimethoxyphenyl)methyl]piperidin-3-yl]-5-(4-fluorophenyl)-2-methyl-pyrimidine

Systemtic Name: 4-[1-[(2,5-dimethoxyphenyl)methyl]piperidin-3-yl]-5-(4-fluorophenyl)-2-methyl-pyrimidine Openeye Name: 4-[1-[(2,5-dimethoxyphenyl)methyl]-3-piperidyl]-5-(4-fluorophenyl)-2-methyl-pyrimidine CAS Name: 4-[1-[(2,5-dimethoxyphenyl)methyl]-3-piperidinyl]-5-(4-fluorophenyl)-2-methylpyrimidine IUPAC Name: 4-[1-[(2,5-dimethoxyphenyl)methyl]piperidin-3-yl]-5-(4-fluorophenyl)-2-methylpyrimidine Traditional Name: 4-[1-(2,5-dimethoxybenzyl)-3-piperidyl]-5-(4-fluorophenyl)-2-methyl-pyrimidine Formula: C25H28FN3O2 MolecularWeight: 421.507123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)C2CCCN(C2)CC3=C(C=CC(=C3)OC)OC)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NC=C(C(=N1)C2CCCN(C2)CC3=C(C=CC(=C3)OC)OC)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H28FN3O2/c1-17-27-14-23(18-6-8-21(26)9-7-18)25(28-17)19-5-4-12-29(15-19)16-20-13-22(30-2)10-11-24(20)31-3/h6-11,13-14,19H,4-5,12,15-16H2,1-3H3