3-(4-methoxyphenyl)-1-[4-[5-(2-methylphenyl)-2-pyridin-3-yl-pyrimidin-4-yl]piperidin-1-yl]propan-1-one

Systemtic Name: 3-(4-methoxyphenyl)-1-[4-[5-(2-methylphenyl)-2-pyridin-3-yl-pyrimidin-4-yl]piperidin-1-yl]propan-1-one Openeye Name: 3-(4-methoxyphenyl)-1-[4-[5-(o-tolyl)-2-(3-pyridyl)pyrimidin-4-yl]-1-piperidyl]propan-1-one CAS Name: 3-(4-methoxyphenyl)-1-[4-[5-(2-methylphenyl)-2-(3-pyridinyl)-4-pyrimidinyl]-1-piperidinyl]-1-propanone IUPAC Name: 3-(4-methoxyphenyl)-1-[4-[5-(2-methylphenyl)-2-pyridin-3-ylpyrimidin-4-yl]piperidin-1-yl]propan-1-one Traditional Name: 3-(4-methoxyphenyl)-1-[4-[5-(o-tolyl)-2-(3-pyridyl)pyrimidin-4-yl]piperidino]propan-1-one Formula: C31H32N4O2 MolecularWeight: 492.61138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CN=C(N=C2C3CCN(CC3)C(=O)CCC4=CC=C(C=C4)OC)C5=CN=CC=C5

Isomeric SMILES

CC1=CC=CC=C1C2=CN=C(N=C2C3CCN(CC3)C(=O)CCC4=CC=C(C=C4)OC)C5=CN=CC=C5

InChI

InChI=1S/C31H32N4O2/c1-22-6-3-4-8-27(22)28-21-33-31(25-7-5-17-32-20-25)34-30(28)24-15-18-35(19-16-24)29(36)14-11-23-9-12-26(37-2)13-10-23/h3-10,12-13,17,20-21,24H,11,14-16,18-19H2,1-2H3