(2S,3R)-3-(4-methylphenyl)-1,2-diphenyl-3-(pyrimidin-2-ylamino)propan-1-one

Systemtic Name: (2S,3R)-3-(4-methylphenyl)-1,2-diphenyl-3-(pyrimidin-2-ylamino)propan-1-one Openeye Name: (2S,3R)-1,2-diphenyl-3-(p-tolyl)-3-(pyrimidin-2-ylamino)propan-1-one CAS Name: (2S,3R)-3-(4-methylphenyl)-1,2-diphenyl-3-(2-pyrimidinylamino)-1-propanone IUPAC Name: (2S,3R)-3-(4-methylphenyl)-1,2-diphenyl-3-(pyrimidin-2-ylamino)propan-1-one Traditional Name: (2S,3R)-1,2-diphenyl-3-(p-tolyl)-3-(2-pyrimidylamino)propan-1-one Formula: C26H23N3O MolecularWeight: 393.48032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)NC4=NC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]([C@H](C2=CC=CC=C2)C(=O)C3=CC=CC=C3)NC4=NC=CC=N4

InChI

InChI=1S/C26H23N3O/c1-19-13-15-21(16-14-19)24(29-26-27-17-8-18-28-26)23(20-9-4-2-5-10-20)25(30)22-11-6-3-7-12-22/h2-18,23-24H,1H3,(H,27,28,29)/t23-,24-/m0/s1