Molecule record

4-[6-amino-5-bromo-2-(4-cyanoanilino)pyrimidin-4-yl]oxy-3,5-dimethylbenzonitrile

C₂₀H₁₅BrN₆O

435.29 g/mol

Loading structure

Molecular properties

Alkane / alkyl carbon

Aromatic ring

Aryl halide

Ether

Nitrile

Primary amine

Secondary amine

No source-backed physical properties are curated for this molecule yet.

0C50HW4FO1
269055-15-4
4-((6-Amino-5-bromo-2-((4-cyanophenyl)amino)pyrimidin-4-yl)oxy)-3,5-dimethylbenzonitrile
4-((6-amino-5-bromo-2-((4-cyanophenyl)amino)-4-pyrimidinyl)oxy)-3,5-dimethyl-benzonitrile
4-[[6-AMINO-5-BROMO-2-[(4-CYANOPHENYL)AMINO]-4-PYRIMIDINYL]OXY]-3,5-DIMETHYLBENZONITRILE
682-331-6
Benzonitrile, 4-((6-amino-5-bromo-2-((4-cyanophenyl)amino)-4-pyrimidinyl)oxy)-3,5-dimethyl-
CHEBI:63589

Show all 24 synonyms

Canonical SMILES: Cc1cc(C#N)cc(C)c1Oc1nc(Nc2ccc(C#N)cc2)nc(N)c1Br
Isomeric SMILES: CC1=CC(=CC(=C1OC2=NC(=NC(=C2Br)N)NC3=CC=C(C=C3)C#N)C)C#N
InChI: InChI=1S/C20H15BrN6O/c1-11-7-14(10-23)8-12(2)17(11)28-19-16(21)18(24)26-20(27-19)25-15-5-3-13(9-22)4-6-15/h3-8H,1-2H3,(H3,24,25,26,27)
InChIKey: PYGWGZALEOIKDF-UHFFFAOYSA-N
PubChem CID: 193962

Tabs appear only for spectra stored with clear provenance.

No redistributable or simulated spectroscopy record is attached yet.

On-demand educational prediction for 4-[6-amino-5-bromo-2-(4-cyanoanilino)pyrimidin-4-yl]oxy-3,5-dimethylbenzonitrile; not experimental data.

On-demand educational fragmentation for 4-[6-amino-5-bromo-2-(4-cyanoanilino)pyrimidin-4-yl]oxy-3,5-dimethylbenzonitrile; not experimental data.

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.