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Details

Stereochemistry ACHIRAL
Molecular Formula C8H13N3O5S
Molecular Weight 263.271
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 2-(5-HYDROXY-2-METHYL-4-NITRO-1-IMIDAZOLYL)ETHYL SULPHONE

SMILES

CCS(=O)(=O)CCN1C(C)=NC(=C1O)[N+]([O-])=O

InChI

InChIKey=ZJWKRPPNTALLIT-UHFFFAOYSA-N
InChI=1S/C8H13N3O5S/c1-3-17(15,16)5-4-10-6(2)9-7(8(10)12)11(13)14/h12H,3-5H2,1-2H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
ETHYL 2-(5-HYDROXY-2-METHYL-4-NITRO-1-IMIDAZOLYL)ETHYL SULPHONE
Systematic Name English
1H-IMIDAZOL-5-OL, 1-(2-(ETHYLSULFONYL)ETHYL)-2-METHYL-4-NITRO-
Systematic Name English
ETHYL 2-(5-HYDROXY-2-METHYL-4-NITRO-1-IMIDAZOLYL)ETHYLSULFONE
Systematic Name English
TINIDAZOLE METABOLITE ETHYL 2-(5-HYDROXY-2-METHYL-4-NITRO-1-IMIDAZOLYL)ETHYL SULPHONE
Common Name English
Code System Code Type Description
PUBCHEM
126051
Created by admin on Sat Dec 16 12:38:23 GMT 2023 , Edited by admin on Sat Dec 16 12:38:23 GMT 2023
PRIMARY
CAS
96740-74-8
Created by admin on Sat Dec 16 12:38:23 GMT 2023 , Edited by admin on Sat Dec 16 12:38:23 GMT 2023
PRIMARY
EPA CompTox
DTXSID90242497
Created by admin on Sat Dec 16 12:38:23 GMT 2023 , Edited by admin on Sat Dec 16 12:38:23 GMT 2023
PRIMARY
FDA UNII
U893LIC9LN
Created by admin on Sat Dec 16 12:38:23 GMT 2023 , Edited by admin on Sat Dec 16 12:38:23 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of TINIDAZOLE
NIH
NCATS
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