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Details

Stereochemistry RACEMIC
Molecular Formula C17H13F4N3O4S
Molecular Weight 431.361
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5N-BICALUTAMIDE

SMILES

CC(O)(CS(=O)(=O)C1=CC=C(F)C=C1)C(=O)NC2=CN=C(C#N)C(=C2)C(F)(F)F

InChI

InChIKey=JWQMHMGGGRQTSY-UHFFFAOYSA-N
InChI=1S/C17H13F4N3O4S/c1-16(26,9-29(27,28)12-4-2-10(18)3-5-12)15(25)24-11-6-13(17(19,20)21)14(7-22)23-8-11/h2-6,8,26H,9H2,1H3,(H,24,25)

HIDE SMILES / InChI

Molecular Formula C17H13F4N3O4S
Molecular Weight 431.361
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:59:57 GMT 2023
Edited
by admin
on Sat Dec 16 18:59:57 GMT 2023
Record UNII
5SNH85A34V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5N-BICALUTAMIDE
Common Name English
N-(6-CYANO-5-(TRIFLUOROMETHYL)-3-PYRIDINYL)-3-((4-FLUOROPHENYL)SULFONYL)-2-HYDROXY-2-METHYLPROPANAMIDE
Systematic Name English
5-AZABICALUTAMIDE
Common Name English
PROPANAMIDE, N-(6-CYANO-5-(TRIFLUOROMETHYL)-3-PYRIDINYL)-3-((4-FLUOROPHENYL)SULFONYL)-2-HYDROXY-2-METHYL-
Systematic Name English
Code System Code Type Description
WIKIPEDIA
5N-Bicalutamide
Created by admin on Sat Dec 16 18:59:57 GMT 2023 , Edited by admin on Sat Dec 16 18:59:57 GMT 2023
PRIMARY
EPA CompTox
DTXSID901337348
Created by admin on Sat Dec 16 18:59:57 GMT 2023 , Edited by admin on Sat Dec 16 18:59:57 GMT 2023
PRIMARY
FDA UNII
5SNH85A34V
Created by admin on Sat Dec 16 18:59:57 GMT 2023 , Edited by admin on Sat Dec 16 18:59:57 GMT 2023
PRIMARY
PUBCHEM
118614933
Created by admin on Sat Dec 16 18:59:57 GMT 2023 , Edited by admin on Sat Dec 16 18:59:57 GMT 2023
PRIMARY
CAS
1845688-96-1
Created by admin on Sat Dec 16 18:59:57 GMT 2023 , Edited by admin on Sat Dec 16 18:59:57 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY