N2-[(2R)-4-(cyclopropylamino)-1-phenyl-butan-2-yl]-N4-methyl-N4-(2-phenylpyrimidin-4-yl)pyrimidine-2,4-diamine

Systemtic Name: N2-[(2R)-4-(cyclopropylamino)-1-phenyl-butan-2-yl]-N4-methyl-N4-(2-phenylpyrimidin-4-yl)pyrimidine-2,4-diamine Openeye Name: N2-[(1R)-1-benzyl-3-(cyclopropylamino)propyl]-N4-methyl-N4-(2-phenylpyrimidin-4-yl)pyrimidine-2,4-diamine CAS Name: N2-[(2R)-4-(cyclopropylamino)-1-phenylbutan-2-yl]-N4-methyl-N4-(2-phenyl-4-pyrimidinyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-[(2R)-4-(cyclopropylamino)-1-phenylbutan-2-yl]-4-N-methyl-4-N-(2-phenylpyrimidin-4-yl)pyrimidine-2,4-diamine Traditional Name: [2-[[(1R)-1-benzyl-3-(cyclopropylamino)propyl]amino]pyrimidin-4-yl]-methyl-(2-phenylpyrimidin-4-yl)amine Formula: C28H31N7 MolecularWeight: 465.59264

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC(=NC=C1)C2=CC=CC=C2)C3=NC(=NC=C3)NC(CCNC4CC4)CC5=CC=CC=C5

Isomeric SMILES

CN(C1=NC(=NC=C1)C2=CC=CC=C2)C3=NC(=NC=C3)N[C@@H](CCNC4CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H31N7/c1-35(25-15-18-30-27(33-25)22-10-6-3-7-11-22)26-16-19-31-28(34-26)32-24(14-17-29-23-12-13-23)20-21-8-4-2-5-9-21/h2-11,15-16,18-19,23-24,29H,12-14,17,20H2,1H3,(H,31,32,34)/t24-/m0/s1