4-[1-[(2-fluoranyl-5-methoxy-phenyl)methyl]piperidin-3-yl]-5-(2-methylphenyl)-2-pyridin-4-yl-pyrimidine

Systemtic Name: 4-[1-[(2-fluoranyl-5-methoxy-phenyl)methyl]piperidin-3-yl]-5-(2-methylphenyl)-2-pyridin-4-yl-pyrimidine Openeye Name: 4-[1-[(2-fluoro-5-methoxy-phenyl)methyl]-3-piperidyl]-5-(o-tolyl)-2-(4-pyridyl)pyrimidine CAS Name: 4-[1-[(2-fluoro-5-methoxyphenyl)methyl]-3-piperidinyl]-5-(2-methylphenyl)-2-pyridin-4-ylpyrimidine IUPAC Name: 4-[1-[(2-fluoro-5-methoxyphenyl)methyl]piperidin-3-yl]-5-(2-methylphenyl)-2-pyridin-4-ylpyrimidine Traditional Name: 4-[1-(2-fluoro-5-methoxy-benzyl)-3-piperidyl]-5-(o-tolyl)-2-(4-pyridyl)pyrimidine Formula: C29H29FN4O MolecularWeight: 468.565163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CN=C(N=C2C3CCCN(C3)CC4=C(C=CC(=C4)OC)F)C5=CC=NC=C5

Isomeric SMILES

CC1=CC=CC=C1C2=CN=C(N=C2C3CCCN(C3)CC4=C(C=CC(=C4)OC)F)C5=CC=NC=C5

InChI

InChI=1S/C29H29FN4O/c1-20-6-3-4-8-25(20)26-17-32-29(21-11-13-31-14-12-21)33-28(26)22-7-5-15-34(18-22)19-23-16-24(35-2)9-10-27(23)30/h3-4,6,8-14,16-17,22H,5,7,15,18-19H2,1-2H3