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Details

Stereochemistry ACHIRAL
Molecular Formula C28H27ClO4S
Molecular Weight 495.03
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of L-796449

SMILES

CCCC1=C2OC=C(C2=CC=C1OCCCSC3=CC=C(CC(O)=O)C=C3Cl)C4=CC=CC=C4

InChI

InChIKey=KAPDPGZDHUCILF-UHFFFAOYSA-N
InChI=1S/C28H27ClO4S/c1-2-7-22-25(12-11-21-23(18-33-28(21)22)20-8-4-3-5-9-20)32-14-6-15-34-26-13-10-19(16-24(26)29)17-27(30)31/h3-5,8-13,16,18H,2,6-7,14-15,17H2,1H3,(H,30,31)

HIDE SMILES / InChI

Molecular Formula C28H27ClO4S
Molecular Weight 495.03
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:08:19 GMT 2023
Edited
by admin
on Sat Dec 16 09:08:19 GMT 2023
Record UNII
O937X0Z5EM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
L-796449
Common Name English
BENZENEACETIC ACID, 3-CHLORO-4-((3-((3-PHENYL-7-PROPYL-6-BENZOFURANYL)OXY)PROPYL)THIO)-
Systematic Name English
Code System Code Type Description
PUBCHEM
9891946
Created by admin on Sat Dec 16 09:08:19 GMT 2023 , Edited by admin on Sat Dec 16 09:08:19 GMT 2023
PRIMARY
CAS
194608-80-5
Created by admin on Sat Dec 16 09:08:19 GMT 2023 , Edited by admin on Sat Dec 16 09:08:19 GMT 2023
PRIMARY
FDA UNII
O937X0Z5EM
Created by admin on Sat Dec 16 09:08:19 GMT 2023 , Edited by admin on Sat Dec 16 09:08:19 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY