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Details

Stereochemistry ACHIRAL
Molecular Formula C14H12FN3O2S
Molecular Weight 305.327
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-{[(4-fluorophenyl)methyl]amino}-2H-1lambda6,2,3-benzothiadiazine-1,1-dione

SMILES

FC1=CC=C(CNC2=NNS(=O)(=O)C3=CC=CC=C23)C=C1

InChI

InChIKey=VYRXJABLUQTIJZ-UHFFFAOYSA-N
InChI=1S/C14H12FN3O2S/c15-11-7-5-10(6-8-11)9-16-14-12-3-1-2-4-13(12)21(19,20)18-17-14/h1-8,18H,9H2,(H,16,17)

HIDE SMILES / InChI

Molecular Formula C14H12FN3O2S
Molecular Weight 305.327
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 12:57:23 GMT 2023
Edited
by admin
on Sat Dec 16 12:57:23 GMT 2023
Record UNII
W4TD6T83GW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-{[(4-fluorophenyl)methyl]amino}-2H-1lambda6,2,3-benzothiadiazine-1,1-dione
Systematic Name English
4-((4-FLUOROBENZYL)AMINO)-1LAMBDA(4),2,3-BENZOTHIADIAZIN-1-OL 1-OXIDE
Systematic Name English
NSC-645787
Code English
N-[(4-fluorophenyl)methyl]-5-hydroxy-5-oxo-5λ6-thia-3,4-diazabicyclo[4.4.0]deca-1(10),2,4,6,8-pentaen-2-amine
Systematic Name English
2H-1,2,3-Benzothiadiazin-4-amine, N-[(4-fluorophenyl)methyl]-, 1,1-dioxide
Systematic Name English
Code System Code Type Description
NSC
645787
Created by admin on Sat Dec 16 12:57:23 GMT 2023 , Edited by admin on Sat Dec 16 12:57:23 GMT 2023
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EPA CompTox
DTXSID40156116
Created by admin on Sat Dec 16 12:57:23 GMT 2023 , Edited by admin on Sat Dec 16 12:57:23 GMT 2023
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FDA UNII
W4TD6T83GW
Created by admin on Sat Dec 16 12:57:23 GMT 2023 , Edited by admin on Sat Dec 16 12:57:23 GMT 2023
PRIMARY
PUBCHEM
438541
Created by admin on Sat Dec 16 12:57:23 GMT 2023 , Edited by admin on Sat Dec 16 12:57:23 GMT 2023
PRIMARY
CAS
129226-06-8
Created by admin on Sat Dec 16 12:57:23 GMT 2023 , Edited by admin on Sat Dec 16 12:57:23 GMT 2023
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