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Erlotinib

CAS Registry Number®

183321-74-6

CAS Name

Erlotinib

Molecular Formula

C22H23N3O4

Molecular Mass

393.44

Cite this Page

Erlotinib.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=183321-74-6 (retrieved 2024-11-25) (CAS RN: 183321-74-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    159-160 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H23N3O4/c1-4-16-6-5-7-17(12-16)25-22-18-13-20(28-10-8-26-2)21(29-11-9-27-3)14-19(18)23-15-24-22/h1,5-7,12-15H,8-11H2,2-3H3,(H,23,24,25)

InChIKey

InChIKey=AAKJLRGGTJKAMG-UHFFFAOYSA-N

SMILES

N(C=1C2=C(C=C(OCCOC)C(OCCOC)=C2)N=CN1)C3=CC(C#C)=CC=C3

Canonical SMILES

C#CC1=CC=CC(=C1)NC=2N=CN=C3C=C(OCCOC)C(OCCOC)=CC32

Other Names for this Substance

  • 4-Quinazolinamine, N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)-
  • N-(3-Ethynylphenyl)-6,7-bis(2-methoxyethoxy)-4-quinazolinamine
  • OSI 744
  • Erlotinib
  • NSC 718781

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