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Details

Stereochemistry ACHIRAL
Molecular Formula C17H20N4O2
Molecular Weight 312.3663
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(3-((1H-1,2,4-TRIAZOL-1-YL)METHYL)-5-(2-CYANOPROPAN-2-YL)PHENYL)-2-METHYLPROPANOIC ACID

SMILES

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

InChI

InChIKey=MVGZBWCFHURVNS-UHFFFAOYSA-N
InChI=1S/C17H20N4O2/c1-16(2,9-18)13-5-12(8-21-11-19-10-20-21)6-14(7-13)17(3,4)15(22)23/h5-7,10-11H,8H2,1-4H3,(H,22,23)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
2-(3-((1H-1,2,4-TRIAZOL-1-YL)METHYL)-5-(2-CYANOPROPAN-2-YL)PHENYL)-2-METHYLPROPANOIC ACID
Systematic Name English
3-(1-CYANO-1-METHYLETHYL)-.ALPHA.,.ALPHA.-DIMETHYL-5-(1H-1,2,4-TRIAZOL-1-YLMETHYL)BENZENEACETIC ACID
Systematic Name English
ANASTROZOLE NITRILE ACID
Common Name English
BENZENEACETIC ACID, 3-(1-CYANO-1-METHYLETHYL)-.ALPHA.,.ALPHA.-DIMETHYL-5-(1H-1,2,4-TRIAZOL-1-YLMETHYL)-
Systematic Name English
ANASTROZOLE MONOACID
Common Name English
Code System Code Type Description
FDA UNII
PZ2ECR4ZKU
Created by admin on Sat Dec 16 10:50:09 GMT 2023 , Edited by admin on Sat Dec 16 10:50:09 GMT 2023
PRIMARY
CAS
1338800-82-0
Created by admin on Sat Dec 16 10:50:09 GMT 2023 , Edited by admin on Sat Dec 16 10:50:09 GMT 2023
PRIMARY
PUBCHEM
123361825
Created by admin on Sat Dec 16 10:50:09 GMT 2023 , Edited by admin on Sat Dec 16 10:50:09 GMT 2023
PRIMARY
EPA CompTox
DTXSID401124564
Created by admin on Sat Dec 16 10:50:09 GMT 2023 , Edited by admin on Sat Dec 16 10:50:09 GMT 2023
PRIMARY
NIH
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