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Details

Stereochemistry ACHIRAL
Molecular Formula C27H27NO2S
Molecular Weight 429.574
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-[2-[4-(6-Methoxy-2-phenylbenzo[b]thien-3-yl)phenoxy]ethyl]pyrrolidine

SMILES

COC1=CC=C2C(SC(=C2C3=CC=C(OCCN4CCCC4)C=C3)C5=CC=CC=C5)=C1

InChI

InChIKey=UBSYZHNXWQNAPG-UHFFFAOYSA-N
InChI=1S/C27H27NO2S/c1-29-23-13-14-24-25(19-23)31-27(21-7-3-2-4-8-21)26(24)20-9-11-22(12-10-20)30-18-17-28-15-5-6-16-28/h2-4,7-14,19H,5-6,15-18H2,1H3

HIDE SMILES / InChI

Molecular Formula C27H27NO2S
Molecular Weight 429.574
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 09:51:32 GMT 2023
Edited
by admin
on Sat Dec 16 09:51:32 GMT 2023
Record UNII
C9HS63V66A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-[2-[4-(6-Methoxy-2-phenylbenzo[b]thien-3-yl)phenoxy]ethyl]pyrrolidine
Systematic Name English
Pyrrolidine, 1-[2-[4-(6-methoxy-2-phenylbenzo[b]thien-3-yl)phenoxy]ethyl]-
Systematic Name English
Code System Code Type Description
PUBCHEM
214811
Created by admin on Sat Dec 16 09:51:32 GMT 2023 , Edited by admin on Sat Dec 16 09:51:32 GMT 2023
PRIMARY
EPA CompTox
DTXSID20187847
Created by admin on Sat Dec 16 09:51:32 GMT 2023 , Edited by admin on Sat Dec 16 09:51:32 GMT 2023
PRIMARY
FDA UNII
C9HS63V66A
Created by admin on Sat Dec 16 09:51:32 GMT 2023 , Edited by admin on Sat Dec 16 09:51:32 GMT 2023
PRIMARY
CAS
34289-01-5
Created by admin on Sat Dec 16 09:51:32 GMT 2023 , Edited by admin on Sat Dec 16 09:51:32 GMT 2023
PRIMARY