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

Systemtic Name: N4,N4-dimethyl-N6-(4-methylphenyl)-2-[4-(3-phenylmethoxyphenyl)piperazin-1-yl]pyrimidine-4,6-diamine Openeye Name: 2-[4-(3-benzyloxyphenyl)piperazin-1-yl]-N4,N4-dimethyl-N6-(p-tolyl)pyrimidine-4,6-diamine CAS Name: N4,N4-dimethyl-N6-(4-methylphenyl)-2-[4-(3-phenylmethoxyphenyl)-1-piperazinyl]pyrimidine-4,6-diamine IUPAC Name: 4-N,4-N-dimethyl-6-N-(4-methylphenyl)-2-[4-(3-phenylmethoxyphenyl)piperazin-1-yl]pyrimidine-4,6-diamine Traditional Name: [2-[4-(3-benzoxyphenyl)piperazino]-6-(p-toluidino)pyrimidin-4-yl]-dimethyl-amine Formula: C30H34N6O MolecularWeight: 494.63056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=CC(=NC(=N2)N3CCN(CC3)C4=CC(=CC=C4)OCC5=CC=CC=C5)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=CC(=NC(=N2)N3CCN(CC3)C4=CC(=CC=C4)OCC5=CC=CC=C5)N(C)C

InChI

InChI=1S/C30H34N6O/c1-23-12-14-25(15-13-23)31-28-21-29(34(2)3)33-30(32-28)36-18-16-35(17-19-36)26-10-7-11-27(20-26)37-22-24-8-5-4-6-9-24/h4-15,20-21H,16-19,22H2,1-3H3,(H,31,32,33)