axitinib (CHEBI:66910)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	axitinib

ChEBI ID	CHEBI:66910

Definition	An indazole substituted at position 3 by a 2-(pyridin-2-yl)vinyl group and at position 6 by a 2-(N-methylaminocarboxy)phenylsulfanyl group. Used for the treatment of advanced renal cell carcinoma after failure of a first line systemic treatment.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

more structures >>

Wikipedia	License

Read full article at Wikipedia

Formula

C22H18N4OS

Net Charge

Average Mass

386.47000

Monoisotopic Mass

386.12013

InChI

InChI=1S/C22H18N4OS/c1-23-22(27)18-7-2-3-8-21(18)28-16-10-11-17-19(25-26-20(17)14-16)12-9-15-6-4-5-13-24-15/h2-14H,1H3,(H,23,27)(H,25,26)/b12-9+

InChIKey

RITAVMQDGBJQJZ-FMIVXFBMSA-N

SMILES

CNC(=O)c1ccccc1Sc1ccc2c(\C=C\c3ccccn3)n[nH]c2c1

Roles Classification
Biological Role(s):	tyrosine kinase inhibitor Any protein kinase inhibitor that interferes with the action of tyrosine kinase. vascular endothelial growth factor receptor antagonist An antagonist at the vascular endothelial growth factor receptor.

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology
Outgoing	axitinib (CHEBI:66910) has role antineoplastic agent (CHEBI:35610) axitinib (CHEBI:66910) has role tyrosine kinase inhibitor (CHEBI:38637) axitinib (CHEBI:66910) has role vascular endothelial growth factor receptor antagonist (CHEBI:65207) axitinib (CHEBI:66910) is a aryl sulfide (CHEBI:35683) axitinib (CHEBI:66910) is a benzamides (CHEBI:22702) axitinib (CHEBI:66910) is a indazoles (CHEBI:38769) axitinib (CHEBI:66910) is a pyridines (CHEBI:26421)

IUPAC Name

N-methyl-2-({3-[(E)-2-(pyridin-2-yl)ethenyl]-1H-indazol-6-yl}sulfanyl)benzamide

Synonyms	Sources
AG-013736	ChemIDplus
N-methyl-2-({3-[(E)-2-(pyridin-2-yl)vinyl]-1H-indazol-6-yl}sulfanyl)benzamide	IUPAC

Brand Name	Source
Inlyta	KEGG DRUG

Last Modified

22 February 2017