N4,N4-dimethyl-N6-(3-phenylmethoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-4,6-diamine

Systemtic Name: N4,N4-dimethyl-N6-(3-phenylmethoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-4,6-diamine Openeye Name: N6-(3-benzyloxyphenyl)-N4,N4-dimethyl-2-[4-(2-pyridyl)piperazin-1-yl]pyrimidine-4,6-diamine CAS Name: N4,N4-dimethyl-N6-(3-phenylmethoxyphenyl)-2-[4-(2-pyridinyl)-1-piperazinyl]pyrimidine-4,6-diamine IUPAC Name: 4-N,4-N-dimethyl-6-N-(3-phenylmethoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-4,6-diamine Traditional Name: [6-(3-benzoxyanilino)-2-[4-(2-pyridyl)piperazino]pyrimidin-4-yl]-dimethyl-amine Formula: C28H31N7O MolecularWeight: 481.59204

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC(=C1)NC2=CC(=CC=C2)OCC3=CC=CC=C3)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CN(C)C1=NC(=NC(=C1)NC2=CC(=CC=C2)OCC3=CC=CC=C3)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C28H31N7O/c1-33(2)27-20-25(30-23-11-8-12-24(19-23)36-21-22-9-4-3-5-10-22)31-28(32-27)35-17-15-34(16-18-35)26-13-6-7-14-29-26/h3-14,19-20H,15-18,21H2,1-2H3,(H,30,31,32)