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Details

Stereochemistry ACHIRAL
Molecular Formula C12H20N2O4S
Molecular Weight 288.363
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 2,2'-THIODIETHANOL BIS(3-AMINOCROTONATE)

SMILES

C\C(N)=C\C(=O)OCCSCCOC(=O)\C=C(/C)N

InChI

InChIKey=GZVBGWRBVGVPLI-FKJILZIQSA-N
InChI=1S/C12H20N2O4S/c1-9(13)7-11(15)17-3-5-19-6-4-18-12(16)8-10(2)14/h7-8H,3-6,13-14H2,1-2H3/b9-7-,10-8+

HIDE SMILES / InChI

Molecular Formula C12H20N2O4S
Molecular Weight 288.363
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:57:07 GMT 2023
Edited
by admin
on Fri Dec 15 17:57:07 GMT 2023
Record UNII
NV4QFI538P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,2'-THIODIETHANOL BIS(3-AMINOCROTONATE)
Systematic Name English
ADVASTAB A 70
Brand Name English
CROTONIC ACID, 3-AMINO-, THIODIETHYLENE ESTER
Systematic Name English
THIODIETHANE-1,2-DIYL BIS(3-AMINOBUT-2-ENOATE)
Systematic Name English
2-BUTENOIC ACID, 3-AMINO-, THIODI-2,1-ETHANEDIYL ESTER
Systematic Name English
3-THIA-1,5-PENTANEDIOL BIS(.BETA.-AMINOCROTONATE)
Systematic Name English
ETHANOL, 2,2'-THIODI-, BIS(3-AMINOCROTONATE)
Systematic Name English
2-BUTENOIC ACID, 3-AMINO-, 1,1'-(THIODI-2,1-ETHANEDIYL) ESTER
Systematic Name English
THIODIETHYLENE .BETA.-AMINOCROTONATE
Systematic Name English
THIODIETHYLENE GLYCOL BIS(.BETA.-AMINOCROTONATE)
Systematic Name English
Code System Code Type Description
PUBCHEM
6437822
Created by admin on Fri Dec 15 17:57:08 GMT 2023 , Edited by admin on Fri Dec 15 17:57:08 GMT 2023
PRIMARY
EPA CompTox
DTXSID801014773
Created by admin on Fri Dec 15 17:57:08 GMT 2023 , Edited by admin on Fri Dec 15 17:57:08 GMT 2023
PRIMARY
CAS
13560-49-1
Created by admin on Fri Dec 15 17:57:08 GMT 2023 , Edited by admin on Fri Dec 15 17:57:08 GMT 2023
PRIMARY
ECHA (EC/EINECS)
236-946-8
Created by admin on Fri Dec 15 17:57:08 GMT 2023 , Edited by admin on Fri Dec 15 17:57:08 GMT 2023
PRIMARY
FDA UNII
NV4QFI538P
Created by admin on Fri Dec 15 17:57:08 GMT 2023 , Edited by admin on Fri Dec 15 17:57:08 GMT 2023
PRIMARY