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Details

Stereochemistry ACHIRAL
Molecular Formula C17H20N4O4S2
Molecular Weight 408.495
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL (2,6-BIS-ACETYLAMINO-4-METHYL-4,8-DIHYDROBENZO(1,2-D;5,4-D')BISTHIAZOL-4-YL)ACETATE

SMILES

CCOC(=O)CC1(C)C2=C(CC3=C1N=C(NC(C)=O)S3)SC(NC(C)=O)=N2

InChI

InChIKey=IJKPAIXKAIOBHP-UHFFFAOYSA-N
InChI=1S/C17H20N4O4S2/c1-5-25-12(24)7-17(4)13-10(26-15(20-13)18-8(2)22)6-11-14(17)21-16(27-11)19-9(3)23/h5-7H2,1-4H3,(H,18,20,22)(H,19,21,23)

HIDE SMILES / InChI

Molecular Formula C17H20N4O4S2
Molecular Weight 408.495
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 13:00:54 GMT 2023
Edited
by admin
on Sat Dec 16 13:00:54 GMT 2023
Record UNII
O749QI0LUV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL (2,6-BIS-ACETYLAMINO-4-METHYL-4,8-DIHYDROBENZO(1,2-D;5,4-D')BISTHIAZOL-4-YL)ACETATE
Systematic Name English
NSC-380541
Code English
BENZO(1,2-D:5,4-D')BISTHIAZOLE-4-ACETIC ACID, 2,6-BIS(ACETYLAMINO)-4,8-DIHYDRO-4-METHYL-, ETHYL ESTER
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID90229541
Created by admin on Sat Dec 16 13:00:54 GMT 2023 , Edited by admin on Sat Dec 16 13:00:54 GMT 2023
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NSC
380541
Created by admin on Sat Dec 16 13:00:54 GMT 2023 , Edited by admin on Sat Dec 16 13:00:54 GMT 2023
PRIMARY
FDA UNII
O749QI0LUV
Created by admin on Sat Dec 16 13:00:54 GMT 2023 , Edited by admin on Sat Dec 16 13:00:54 GMT 2023
PRIMARY
PUBCHEM
342788
Created by admin on Sat Dec 16 13:00:54 GMT 2023 , Edited by admin on Sat Dec 16 13:00:54 GMT 2023
PRIMARY
CAS
79115-47-2
Created by admin on Sat Dec 16 13:00:54 GMT 2023 , Edited by admin on Sat Dec 16 13:00:54 GMT 2023
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