Molecular properties
- Formula
- C17H19N5
- Molar mass
- 293.37 g·mol−1
- Exact mass
- 293.1640 Da
- 11
- PubChem CID
- 2187
Molecule record
2-[3-(2-cyanopropan-2-yl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-2-methylpropanenitrile
C17H19N5
293.37 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Nitrile
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 1,3-Benzenediacetonitrile, alpha,alpha,alpha',alpha'-tetramethyl-5-(1H-1,2,4-triazol-1-ylmethyl)-
- 120511-73-1
- 2,2'-(5-(1H-1,2,4-triazol-1-ylmethyl)-1,3-phenylene)bis(2-methylpropionitrile)
- 2-[3-(1-cyano-1-methylethyl)-5-(1H-1,2,4-triazol-1-ylmethyl)phenyl]-2-methylpropanenitrile
- 2Z07MYW1AZ
- Anastrozol
- Anastrozole Tablets
- Arimidex
Show all 24 synonyms
- CHEBI:2704
- DTXCID202607
- DTXSID9022607
- ICI D1033
- NSC-719344
- NSC-759855
- NSC719344
- Nastrosa
- Rvg-106400
- ZD-1033
- ZD1033
- Zeneca ZD 1033
- alpha,alpha,alpha',alpha'-Tetramethyl-5-(1H-1,2,4-triazol-1-ylmethyl)-m-benzenediacetonitrile
- anastrazole
- anastrozole
- anastrozolum
Structure identifiers
- Canonical SMILES
- CC(C)(C#N)c1cc(Cn2cncn2)cc(C(C)(C)C#N)c1
- Isomeric SMILES
- CC(C)(C#N)C1=CC(=CC(=C1)CN2C=NC=N2)C(C)(C)C#N
- InChI
- InChI=1S/C17H19N5/c1-16(2,9-18)14-5-13(8-22-12-20-11-21-22)6-15(7-14)17(3,4)10-19/h5-7,11-12H,8H2,1-4H3
- InChIKey
- YBBLVLTVTVSKRW-UHFFFAOYSA-N
- PubChem CID
- 2187
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 2-[3-(2-cyanopropan-2-yl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-2-methylpropanenitrile; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-[3-(2-cyanopropan-2-yl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-2-methylpropanenitrile; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.