Zafirlukast

CAS Registry Number®

107753-78-6

CAS Name

Zafirlukast

Molecular Formula

C31H33N3O6S

Molecular Mass

575.68

Cite this Page

Zafirlukast.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=107753-78-6 (retrieved 2024-11-21) (CAS RN: 107753-78-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    138-140 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C31H33N3O6S/c1-20-8-4-7-11-29(20)41(37,38)33-30(35)22-13-12-21(28(17-22)39-3)16-23-19-34(2)27-15-14-24(18-26(23)27)32-31(36)40-25-9-5-6-10-25/h4,7-8,11-15,17-19,25H,5-6,9-10,16H2,1-3H3,(H,32,36)(H,33,35)

InChIKey

InChIKey=YEEZWCHGZNKEEK-UHFFFAOYSA-N

SMILES

C(C=1C=2C(N(C)C1)=CC=C(NC(OC3CCCC3)=O)C2)C4=C(OC)C=C(C(NS(=O)(=O)C5=C(C)C=CC=C5)=O)C=C4

Canonical SMILES

O=C(OC1CCCC1)NC=2C=CC3=C(C2)C(=CN3C)CC4=CC=C(C=C4OC)C(=O)NS(=O)(=O)C=5C=CC=CC5C

Other Names for this Substance

  • Carbamic acid, N-[3-[[2-methoxy-4-[[[(2-methylphenyl)sulfonyl]amino]carbonyl]phenyl]methyl]-1-methyl-1H-indol-5-yl]-, cyclopentyl ester
  • Carbamic acid, [3-[[2-methoxy-4-[[[(2-methylphenyl)sulfonyl]amino]carbonyl]phenyl]methyl]-1-methyl-1H-indol-5-yl]-, cyclopentyl ester
  • ICI 204219
  • Cyclopentyl 3-[2-methoxy-4-[(o-tolylsulfonyl)carbamoyl]benzyl]-1-methylindole-5-carbamate
  • Zafirlukast

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration