2-[4-(4-chlorophenyl)piperazin-1-yl]-N4,N4-dimethyl-N6-(3-phenylmethoxyphenyl)pyrimidine-4,6-diamine

Systemtic Name: 2-[4-(4-chlorophenyl)piperazin-1-yl]-N4,N4-dimethyl-N6-(3-phenylmethoxyphenyl)pyrimidine-4,6-diamine Openeye Name: N6-(3-benzyloxyphenyl)-2-[4-(4-chlorophenyl)piperazin-1-yl]-N4,N4-dimethyl-pyrimidine-4,6-diamine CAS Name: 2-[4-(4-chlorophenyl)-1-piperazinyl]-N4,N4-dimethyl-N6-(3-phenylmethoxyphenyl)pyrimidine-4,6-diamine IUPAC Name: 2-[4-(4-chlorophenyl)piperazin-1-yl]-4-N,4-N-dimethyl-6-N-(3-phenylmethoxyphenyl)pyrimidine-4,6-diamine Traditional Name: [6-(3-benzoxyanilino)-2-[4-(4-chlorophenyl)piperazino]pyrimidin-4-yl]-dimethyl-amine Formula: C29H31ClN6O MolecularWeight: 515.04904

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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=C(C=C5)Cl

Isomeric SMILES

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

InChI

InChI=1S/C29H31ClN6O/c1-34(2)28-20-27(31-24-9-6-10-26(19-24)37-21-22-7-4-3-5-8-22)32-29(33-28)36-17-15-35(16-18-36)25-13-11-23(30)12-14-25/h3-14,19-20H,15-18,21H2,1-2H3,(H,31,32,33)