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

Systemtic Name: 4-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-3-yl]-5-phenyl-2-pyridin-4-yl-pyrimidine Openeye Name: 4-[1-[(3,4-dimethoxyphenyl)methyl]-3-piperidyl]-5-phenyl-2-(4-pyridyl)pyrimidine CAS Name: 4-[1-[(3,4-dimethoxyphenyl)methyl]-3-piperidinyl]-5-phenyl-2-pyridin-4-ylpyrimidine IUPAC Name: 4-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-3-yl]-5-phenyl-2-pyridin-4-ylpyrimidine Traditional Name: 5-phenyl-2-(4-pyridyl)-4-(1-veratryl-3-piperidyl)pyrimidine Formula: C29H30N4O2 MolecularWeight: 466.5741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCCC(C2)C3=NC(=NC=C3C4=CC=CC=C4)C5=CC=NC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCCC(C2)C3=NC(=NC=C3C4=CC=CC=C4)C5=CC=NC=C5)OC

InChI

InChI=1S/C29H30N4O2/c1-34-26-11-10-21(17-27(26)35-2)19-33-16-6-9-24(20-33)28-25(22-7-4-3-5-8-22)18-31-29(32-28)23-12-14-30-15-13-23/h3-5,7-8,10-15,17-18,24H,6,9,16,19-20H2,1-2H3