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Details

Stereochemistry ACHIRAL
Molecular Formula C26H29N3O5S
Molecular Weight 495.591
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 5-[2-(1-Ethylnaphtho[1,2-d]thiazol-2(1H)-ylidene)-1-methylethylidene]-1,3-bis(2-methoxyethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione

SMILES

CCN1\C(SC2=CC=C3C=CC=CC3=C12)=C/C(C)=C4C(=O)N(CCOC)C(=O)N(CCOC)C4=O

InChI

InChIKey=HLWYHLPFIFQUDD-LTGZKZEYSA-N
InChI=1S/C26H29N3O5S/c1-5-27-21(35-20-11-10-18-8-6-7-9-19(18)23(20)27)16-17(2)22-24(30)28(12-14-33-3)26(32)29(25(22)31)13-15-34-4/h6-11,16H,5,12-15H2,1-4H3/b21-16+

HIDE SMILES / InChI

Molecular Formula C26H29N3O5S
Molecular Weight 495.591
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:49:55 GMT 2023
Edited
by admin
on Sat Dec 16 11:49:55 GMT 2023
Record UNII
Y5946UTH9Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-[2-(1-Ethylnaphtho[1,2-d]thiazol-2(1H)-ylidene)-1-methylethylidene]-1,3-bis(2-methoxyethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Systematic Name English
Barbituric acid, 5-[2-(1-ethylnaphtho[1,2-d]thiazolin-2-ylidene)-1-methylethylidene]-1,3-bis(2-methoxyethyl)-
Systematic Name English
2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-(2-(1-ETHYLNAPHTHO(1,2-D)THIAZOL-2(1H)-YLIDENE)-1-METHYLETHYLIDENE)-1,3-BIS(2-METHOXYETHYL)-
Systematic Name English
Code System Code Type Description
CAS
27969-53-5
Created by admin on Sat Dec 16 11:49:55 GMT 2023 , Edited by admin on Sat Dec 16 11:49:55 GMT 2023
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FDA UNII
Y5946UTH9Z
Created by admin on Sat Dec 16 11:49:55 GMT 2023 , Edited by admin on Sat Dec 16 11:49:55 GMT 2023
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EPA CompTox
DTXSID9067352
Created by admin on Sat Dec 16 11:49:55 GMT 2023 , Edited by admin on Sat Dec 16 11:49:55 GMT 2023
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ECHA (EC/EINECS)
248-751-5
Created by admin on Sat Dec 16 11:49:55 GMT 2023 , Edited by admin on Sat Dec 16 11:49:55 GMT 2023
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PUBCHEM
6438184
Created by admin on Sat Dec 16 11:49:55 GMT 2023 , Edited by admin on Sat Dec 16 11:49:55 GMT 2023
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