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

Systemtic Name: 4-[1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]-5-(2-methylphenyl)-2-pyridin-4-yl-pyrimidine Openeye Name: 4-[1-[(5-ethyl-2-furyl)methyl]-3-piperidyl]-5-(o-tolyl)-2-(4-pyridyl)pyrimidine CAS Name: 4-[1-[(5-ethyl-2-furanyl)methyl]-3-piperidinyl]-5-(2-methylphenyl)-2-pyridin-4-ylpyrimidine IUPAC Name: 4-[1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]-5-(2-methylphenyl)-2-pyridin-4-ylpyrimidine Traditional Name: 4-[1-[(5-ethyl-2-furyl)methyl]-3-piperidyl]-5-(o-tolyl)-2-(4-pyridyl)pyrimidine Formula: C28H30N4O MolecularWeight: 438.564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)CN2CCCC(C2)C3=NC(=NC=C3C4=CC=CC=C4C)C5=CC=NC=C5

Isomeric SMILES

CCC1=CC=C(O1)CN2CCCC(C2)C3=NC(=NC=C3C4=CC=CC=C4C)C5=CC=NC=C5

InChI

InChI=1S/C28H30N4O/c1-3-23-10-11-24(33-23)19-32-16-6-8-22(18-32)27-26(25-9-5-4-7-20(25)2)17-30-28(31-27)21-12-14-29-15-13-21/h4-5,7,9-15,17,22H,3,6,8,16,18-19H2,1-2H3