U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C28H27NO4S
Molecular Weight 473.583
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-DES(4-(2-PIPERIDINYL)ETHOXY)BENZOYL-7-(4-(2-PIPERIDINYL)ETHOXY)BENZOYL RALOXIFENE

SMILES

OC1=CC=C(C=C1)C2=CC3=CC=C(O)C(C(=O)C4=CC=C(OCCN5CCCCC5)C=C4)=C3S2

InChI

InChIKey=JQIHKQGGHCMOQN-UHFFFAOYSA-N
InChI=1S/C28H27NO4S/c30-22-9-4-19(5-10-22)25-18-21-8-13-24(31)26(28(21)34-25)27(32)20-6-11-23(12-7-20)33-17-16-29-14-2-1-3-15-29/h4-13,18,30-31H,1-3,14-17H2

HIDE SMILES / InChI

Approval Year

Name Type Language
3-DES(4-(2-PIPERIDINYL)ETHOXY)BENZOYL-7-(4-(2-PIPERIDINYL)ETHOXY)BENZOYL RALOXIFENE
Systematic Name English
(6-HYDROXY-2-(4-HYDROXYPHENYL)-1-BENZOTHIOPHEN-7-YL)(4-(2-(PIPERIDIN-1-YL)ETHOXY)PHENYL)METHANONE
Systematic Name English
RALOXIFENE HYDROCHLORIDE IMPURITY B [EP IMPURITY]
Common Name English
METHANONE, (6-HYDROXY-2-(4-HYDROXYPHENYL)BENZO(B)THIEN-7-YL)(4-(2-(1-PIPERIDINYL)ETHOXY)PHENYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
631N7NJH5W
Created by admin on Sat Dec 16 07:54:52 GMT 2023 , Edited by admin on Sat Dec 16 07:54:52 GMT 2023
PRIMARY
PUBCHEM
71315811
Created by admin on Sat Dec 16 07:54:52 GMT 2023 , Edited by admin on Sat Dec 16 07:54:52 GMT 2023
PRIMARY
CAS
1391054-73-1
Created by admin on Sat Dec 16 07:54:52 GMT 2023 , Edited by admin on Sat Dec 16 07:54:52 GMT 2023
PRIMARY