4-[5-(4-methoxyphenyl)pyridin-3-yl]-2-phenyl-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidine

Systemtic Name: 4-[5-(4-methoxyphenyl)pyridin-3-yl]-2-phenyl-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidine Openeye Name: 4-(4-benzylpiperazin-1-yl)-6-[5-(4-methoxyphenyl)-3-pyridyl]-2-phenyl-pyrimidine CAS Name: 4-[5-(4-methoxyphenyl)-3-pyridinyl]-2-phenyl-6-[4-(phenylmethyl)-1-piperazinyl]pyrimidine IUPAC Name: 4-(4-benzylpiperazin-1-yl)-6-[5-(4-methoxyphenyl)pyridin-3-yl]-2-phenylpyrimidine Traditional Name: 4-(4-benzylpiperazino)-6-[5-(4-methoxyphenyl)-3-pyridyl]-2-phenyl-pyrimidine Formula: C33H31N5O MolecularWeight: 513.63214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=CN=C2)C3=CC(=NC(=N3)C4=CC=CC=C4)N5CCN(CC5)CC6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=CN=C2)C3=CC(=NC(=N3)C4=CC=CC=C4)N5CCN(CC5)CC6=CC=CC=C6

InChI

InChI=1S/C33H31N5O/c1-39-30-14-12-26(13-15-30)28-20-29(23-34-22-28)31-21-32(36-33(35-31)27-10-6-3-7-11-27)38-18-16-37(17-19-38)24-25-8-4-2-5-9-25/h2-15,20-23H,16-19,24H2,1H3