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

Systemtic Name: (2S,3R)-3-(4-methoxyphenyl)-1,2-diphenyl-3-(pyrimidin-2-ylamino)propan-1-one Openeye Name: (2S,3R)-3-(4-methoxyphenyl)-1,2-diphenyl-3-(pyrimidin-2-ylamino)propan-1-one CAS Name: (2S,3R)-3-(4-methoxyphenyl)-1,2-diphenyl-3-(2-pyrimidinylamino)-1-propanone IUPAC Name: (2S,3R)-3-(4-methoxyphenyl)-1,2-diphenyl-3-(pyrimidin-2-ylamino)propan-1-one Traditional Name: (2S,3R)-3-(4-methoxyphenyl)-1,2-diphenyl-3-(2-pyrimidylamino)propan-1-one Formula: C26H23N3O2 MolecularWeight: 409.47972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)NC4=NC=CC=N4

Isomeric SMILES

COC1=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/C26H23N3O2/c1-31-22-15-13-20(14-16-22)24(29-26-27-17-8-18-28-26)23(19-9-4-2-5-10-19)25(30)21-11-6-3-7-12-21/h2-18,23-24H,1H3,(H,27,28,29)/t23-,24-/m0/s1