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Details

Stereochemistry ACHIRAL
Molecular Formula C21H19F3N2O4S
Molecular Weight 452.447
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ROVAZOLAC

SMILES

CCOC(=O)CN1N=C(C=C1C2=CC=C(C=C2)C3=CC(=CC=C3)S(C)(=O)=O)C(F)(F)F

InChI

InChIKey=ZUMNJDGBYXHASJ-UHFFFAOYSA-N
InChI=1S/C21H19F3N2O4S/c1-3-30-20(27)13-26-18(12-19(25-26)21(22,23)24)15-9-7-14(8-10-15)16-5-4-6-17(11-16)31(2,28)29/h4-12H,3,13H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C21H19F3N2O4S
Molecular Weight 452.447
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:29:26 GMT 2023
Edited
by admin
on Sat Dec 16 10:29:26 GMT 2023
Record UNII
W51K389XIL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ROVAZOLAC
USAN   INN  
Official Name English
rovazolac [INN]
Common Name English
ETHYL (5-(3'-(METHANESULFONYL)(1,1'-BIPHENYL)-4-YL)-3-(TRIFLUOROMETHYL)-1H-PYRAZOL-1-YL)ACETATE
Systematic Name English
ALX-101
Code English
ROVAZOLAC [USAN]
Common Name English
1H-PYRAZOLE-1-ACETIC ACID, 5-(3'-(METHYLSULFONYL)(1,1'-BIPHENYL)-4-YL)-3-(TRIFLUOROMETHYL)-, ETHYL ESTER
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C257
Created by admin on Sat Dec 16 10:29:26 GMT 2023 , Edited by admin on Sat Dec 16 10:29:26 GMT 2023
Code System Code Type Description
EPA CompTox
DTXSID801122584
Created by admin on Sat Dec 16 10:29:26 GMT 2023 , Edited by admin on Sat Dec 16 10:29:26 GMT 2023
PRIMARY
CAS
1454288-88-0
Created by admin on Sat Dec 16 10:29:26 GMT 2023 , Edited by admin on Sat Dec 16 10:29:26 GMT 2023
PRIMARY
PUBCHEM
89792952
Created by admin on Sat Dec 16 10:29:26 GMT 2023 , Edited by admin on Sat Dec 16 10:29:26 GMT 2023
PRIMARY
SMS_ID
300000034394
Created by admin on Sat Dec 16 10:29:26 GMT 2023 , Edited by admin on Sat Dec 16 10:29:26 GMT 2023
PRIMARY
INN
10487
Created by admin on Sat Dec 16 10:29:26 GMT 2023 , Edited by admin on Sat Dec 16 10:29:26 GMT 2023
PRIMARY
NCI_THESAURUS
C152263
Created by admin on Sat Dec 16 10:29:26 GMT 2023 , Edited by admin on Sat Dec 16 10:29:26 GMT 2023
PRIMARY
FDA UNII
W51K389XIL
Created by admin on Sat Dec 16 10:29:26 GMT 2023 , Edited by admin on Sat Dec 16 10:29:26 GMT 2023
PRIMARY
USAN
FG-37
Created by admin on Sat Dec 16 10:29:26 GMT 2023 , Edited by admin on Sat Dec 16 10:29:26 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY