4-(2,5-dimethoxyphenyl)-2-(4-phenylpiperazin-1-yl)-6-pyridin-4-yl-pyrimidine

Systemtic Name: 4-(2,5-dimethoxyphenyl)-2-(4-phenylpiperazin-1-yl)-6-pyridin-4-yl-pyrimidine Openeye Name: 4-(2,5-dimethoxyphenyl)-2-(4-phenylpiperazin-1-yl)-6-(4-pyridyl)pyrimidine CAS Name: 4-(2,5-dimethoxyphenyl)-2-(4-phenyl-1-piperazinyl)-6-pyridin-4-ylpyrimidine IUPAC Name: 4-(2,5-dimethoxyphenyl)-2-(4-phenylpiperazin-1-yl)-6-pyridin-4-ylpyrimidine Traditional Name: 4-(2,5-dimethoxyphenyl)-2-(4-phenylpiperazino)-6-(4-pyridyl)pyrimidine Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=NC(=NC(=C2)C3=CC=NC=C3)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=NC(=NC(=C2)C3=CC=NC=C3)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N5O2/c1-33-22-8-9-26(34-2)23(18-22)25-19-24(20-10-12-28-13-11-20)29-27(30-25)32-16-14-31(15-17-32)21-6-4-3-5-7-21/h3-13,18-19H,14-17H2,1-2H3