Anastrozole

CAS Registry Number®

120511-73-1

CAS Name

Anastrozole

Molecular Formula

C17H19N5

Molecular Mass

293.37

Cite this Page

Anastrozole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=120511-73-1 (retrieved 2025-01-24) (CAS RN: 120511-73-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    81-82 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

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

InChIKey=YBBLVLTVTVSKRW-UHFFFAOYSA-N

SMILES

C(C#N)(C)(C)C1=CC(C(C#N)(C)C)=CC(CN2C=NC=N2)=C1

Canonical SMILES

N#CC(C1=CC(=CC(=C1)C(C#N)(C)C)CN2N=CN=C2)(C)C

Other Names for this Substance

  • 1,3-Benzenediacetonitrile, α1,α1,α3,α3-tetramethyl-5-(1H-1,2,4-triazol-1-ylmethyl)-
  • 1,3-Benzenediacetonitrile, α,α,α′,α′-tetramethyl-5-(1H-1,2,4-triazol-1-ylmethyl)-
  • α1,α1,α3,α3-Tetramethyl-5-(1H-1,2,4-triazol-1-ylmethyl)-1,3-benzenediacetonitrile
  • Anastrozole
  • ZD 1033

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