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Details

Stereochemistry RACEMIC
Molecular Formula C10H14N2O5S
Molecular Weight 274.294
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl 1-(1,1-dioxidotetrahydrothiophen-2-yl)-5-hydroxy-1H-pyrazole-3-carboxylate

SMILES

CCOC(=O)C1=NN(C2CCS(=O)(=O)C2)C(=O)C1

InChI

InChIKey=DOOAGTACNBXRFC-UHFFFAOYSA-N
InChI=1S/C10H14N2O5S/c1-2-17-10(14)8-5-9(13)12(11-8)7-3-4-18(15,16)6-7/h7H,2-6H2,1H3

HIDE SMILES / InChI

Molecular Formula C10H14N2O5S
Molecular Weight 274.294
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 18:20:47 GMT 2023
Edited
by admin
on Sat Dec 16 18:20:47 GMT 2023
Record UNII
AGP56K36GZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ethyl 1-(1,1-dioxidotetrahydrothiophen-2-yl)-5-hydroxy-1H-pyrazole-3-carboxylate
Systematic Name English
ETHYL 5-HYDROXY-1-(TETRAHYDRO-3-THIENYL)-1H-PYRAZOLE-3-CARBOXYLATES,S-DIOXIDE
Systematic Name English
1H-PYRAZOLE-3-CARBOXYLIC ACID, 4,5-DIHYDRO-5-OXO-1-(TETRAHYDRO-1,1-DIOXIDO-3-THIENYL)-, ETHYL ESTER
Systematic Name English
Ethyl 4,5-dihydro-5-oxo-1-(tetrahydro-1,1-dioxido-3-thienyl)-1H-pyrazole-3-carboxylate
Systematic Name English
2-PYRAZOLINE-3-CARBOXYLIC ACID, 5-OXO-1-(TETRAHYDRO-3-THIENYL)-, ETHYL ESTER, S,S-DIOXIDE
Systematic Name English
Code System Code Type Description
CAS
114841-33-7
Created by admin on Sat Dec 16 18:20:47 GMT 2023 , Edited by admin on Sat Dec 16 18:20:47 GMT 2023
PRIMARY
PUBCHEM
146677419
Created by admin on Sat Dec 16 18:20:47 GMT 2023 , Edited by admin on Sat Dec 16 18:20:47 GMT 2023
PRIMARY
FDA UNII
AGP56K36GZ
Created by admin on Sat Dec 16 18:20:47 GMT 2023 , Edited by admin on Sat Dec 16 18:20:47 GMT 2023
PRIMARY
CAS
51986-04-0
Created by admin on Sat Dec 16 18:20:47 GMT 2023 , Edited by admin on Sat Dec 16 18:20:47 GMT 2023
ALTERNATIVE
EPA CompTox
DTXSID90966303
Created by admin on Sat Dec 16 18:20:47 GMT 2023 , Edited by admin on Sat Dec 16 18:20:47 GMT 2023
PRIMARY