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Details

Stereochemistry RACEMIC
Molecular Formula C14H14O2S
Molecular Weight 246.325
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IDPH-8261

SMILES

COC(=O)C(C)C1=CC=C(C=C1)C2=CSC=C2

InChI

InChIKey=WINXAKJYORVNHU-UHFFFAOYSA-N
InChI=1S/C14H14O2S/c1-10(14(15)16-2)11-3-5-12(6-4-11)13-7-8-17-9-13/h3-10H,1-2H3

HIDE SMILES / InChI

Molecular Formula C14H14O2S
Molecular Weight 246.325
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:55:19 UTC 2023
Edited
by admin
on Sat Dec 16 08:55:19 UTC 2023
Record UNII
J4387865F3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IDPH-8261
Common Name English
ATLIPROFEN METHYL ESTER
Common Name English
BENZENEACETIC ACID, .ALPHA.-METHYL-4-(3-THIENYL)-, METHYL ESTER
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID60869498
Created by admin on Sat Dec 16 08:55:19 UTC 2023 , Edited by admin on Sat Dec 16 08:55:19 UTC 2023
PRIMARY
CAS
108912-17-0
Created by admin on Sat Dec 16 08:55:19 UTC 2023 , Edited by admin on Sat Dec 16 08:55:19 UTC 2023
PRIMARY
FDA UNII
J4387865F3
Created by admin on Sat Dec 16 08:55:19 UTC 2023 , Edited by admin on Sat Dec 16 08:55:19 UTC 2023
PRIMARY
PUBCHEM
130978
Created by admin on Sat Dec 16 08:55:19 UTC 2023 , Edited by admin on Sat Dec 16 08:55:19 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY