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Details

Stereochemistry ACHIRAL
Molecular Formula C11H16N2O4S
Molecular Weight 272.321
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIETHYL 1-METHYL-2-(METHYLTHIO)-1H-IMIDAZOLE-4,5-DICARBOXYLATE

SMILES

CCOC(=O)C1=C(N(C)C(SC)=N1)C(=O)OCC

InChI

InChIKey=QIQRTQYTQIONBC-UHFFFAOYSA-N
InChI=1S/C11H16N2O4S/c1-5-16-9(14)7-8(10(15)17-6-2)13(3)11(12-7)18-4/h5-6H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C11H16N2O4S
Molecular Weight 272.321
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 12:52:22 GMT 2023
Edited
by admin
on Sat Dec 16 12:52:22 GMT 2023
Record UNII
BO7XS85GNB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIETHYL 1-METHYL-2-(METHYLTHIO)-1H-IMIDAZOLE-4,5-DICARBOXYLATE
Systematic Name English
IMIDAZOLE-4,5-DICARBOXYLIC ACID, 1-METHYL-2-(METHYLTHIO)-, DIETHYL ESTER
Systematic Name English
1H-IMIDAZOLE-4,5-DICARBOXYLIC ACID, 1-METHYL-2-(METHYLTHIO)-, DIETHYL ESTER
Systematic Name English
1H-IMIDAZOLE-4,5-DICARBOXYLIC ACID, 1-METHYL-2-(METHYLTHIO)-, 4,5-DIETHYL ESTER
Systematic Name English
NSC-193528
Code English
Code System Code Type Description
EPA CompTox
DTXSID60148598
Created by admin on Sat Dec 16 12:52:22 GMT 2023 , Edited by admin on Sat Dec 16 12:52:22 GMT 2023
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PUBCHEM
303834
Created by admin on Sat Dec 16 12:52:22 GMT 2023 , Edited by admin on Sat Dec 16 12:52:22 GMT 2023
PRIMARY
FDA UNII
BO7XS85GNB
Created by admin on Sat Dec 16 12:52:22 GMT 2023 , Edited by admin on Sat Dec 16 12:52:22 GMT 2023
PRIMARY
CAS
1086-05-1
Created by admin on Sat Dec 16 12:52:22 GMT 2023 , Edited by admin on Sat Dec 16 12:52:22 GMT 2023
PRIMARY
NSC
193528
Created by admin on Sat Dec 16 12:52:22 GMT 2023 , Edited by admin on Sat Dec 16 12:52:22 GMT 2023
PRIMARY