1-[4-[5-(3-methylphenyl)-2-pyridin-4-yl-pyrimidin-4-yl]piperidin-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[4-[5-(3-methylphenyl)-2-pyridin-4-yl-pyrimidin-4-yl]piperidin-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[4-[5-(m-tolyl)-2-(4-pyridyl)pyrimidin-4-yl]-1-piperidyl]-2-phenoxy-ethanone CAS Name: 1-[4-[5-(3-methylphenyl)-2-pyridin-4-yl-4-pyrimidinyl]-1-piperidinyl]-2-phenoxyethanone IUPAC Name: 1-[4-[5-(3-methylphenyl)-2-pyridin-4-ylpyrimidin-4-yl]piperidin-1-yl]-2-phenoxyethanone Traditional Name: 1-[4-[5-(m-tolyl)-2-(4-pyridyl)pyrimidin-4-yl]piperidino]-2-phenoxy-ethanone Formula: C29H28N4O2 MolecularWeight: 464.55822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CN=C(N=C2C3CCN(CC3)C(=O)COC4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

CC1=CC=CC(=C1)C2=CN=C(N=C2C3CCN(CC3)C(=O)COC4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C29H28N4O2/c1-21-6-5-7-24(18-21)26-19-31-29(23-10-14-30-15-11-23)32-28(26)22-12-16-33(17-13-22)27(34)20-35-25-8-3-2-4-9-25/h2-11,14-15,18-19,22H,12-13,16-17,20H2,1H3