5-(4-phenoxyphenyl)-7-(2-phenyl-1,3-dioxan-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(4-phenoxyphenyl)-7-(2-phenyl-1,3-dioxan-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 5-(4-phenoxyphenyl)-7-(2-phenyl-1,3-dioxan-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-phenoxyphenyl)-7-(2-phenyl-1,3-dioxan-5-yl)-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 5-(4-phenoxyphenyl)-7-(2-phenyl-1,3-dioxan-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [5-(4-phenoxyphenyl)-7-(2-phenyl-1,3-dioxan-5-yl)pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C28H24N4O3 MolecularWeight: 464.51516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(COC(O1)C2=CC=CC=C2)N3C=C(C4=C3N=CN=C4N)C5=CC=C(C=C5)OC6=CC=CC=C6

Isomeric SMILES

C1C(COC(O1)C2=CC=CC=C2)N3C=C(C4=C3N=CN=C4N)C5=CC=C(C=C5)OC6=CC=CC=C6

InChI

InChI=1S/C28H24N4O3/c29-26-25-24(19-11-13-23(14-12-19)35-22-9-5-2-6-10-22)15-32(27(25)31-18-30-26)21-16-33-28(34-17-21)20-7-3-1-4-8-20/h1-15,18,21,28H,16-17H2,(H2,29,30,31)