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anastrozole

Properties

Image

Occurences in reactions

MNX_ID

MNXM42042

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₁₇H₁₉N₅

charge

mass

293.16405

reference

InChIKey

YBBLVLTVTVSKRW-UHFFFAOYSA-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

SMILES

CC(C)(C#N)c1cc(Cn2cncn2)cc(C(C)(C)C#N)c1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:2704 chebi:2704	anastrozole 2,2'-[5-(1H-1,2,4-triazol-1-ylmethyl)-1,3-phenylene]bis(2-methylpropanenitrile) Anastrozol alpha,alpha,alpha',alpha'-Tetramethyl-5-(1H-1,2,4-triazol-1-ylmethyl)-m-benzenediacetonitrile
seed.compound:cpd05119 seedM:cpd05119 kegg.compound:C08159 keggC:C08159	Anastrozole
kegg.drug:D00960 keggD:D00960	Anastrozole (JAN/USP/INN) Arimidex (TN)
hmdb:HMDB0015348	Anastrozole 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 Anastrazole Anastrozol Arimidex Astra brand OF anastrozole AstraZeneca brand OF anastrozole ICI D1033 Zeneca ZD 1033 Zeneca brand OF anastrozole a,a,Alpha',alpha'-tetramethyl-5-(1H-1,2,4-triazol-1-ylmethyl)-m-benzenediacetonitrile alpha,alpha,Alpha',alpha'-tetramethyl-5-(1H-1,2,4-triazol-1-ylmethyl)-m-benzenediacetonitrile alpha,alpha,alpha',alpha'-tetramethyl-5-(1H-1,2,4-triazol-1-ylmethyl)-m-benzenediacetonitrile anastrozole
hmdb:HMDB15348 keggC:M_C08159 keggD:M_D00960 seedM:M_cpd05119	secondary/obsolete/fantasy identifier