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Details

Stereochemistry ACHIRAL
Molecular Formula C20H21F3N4O7S2
Molecular Weight 550.529
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-OXO-3-(2-(4-(4-SULFO-3-(TRIFLUOROMETHYL)PHENYL)PIPERAZIN-1-YL)ETHYL)-1H-BENZIMIDAZOLE-5-SULFONIC ACID

SMILES

OS(=O)(=O)C1=CC2=C(NC(=O)N2CCN3CCN(CC3)C4=CC=C(C(=C4)C(F)(F)F)S(O)(=O)=O)C=C1

InChI

InChIKey=GKVARQAEJKPFHX-UHFFFAOYSA-N
InChI=1S/C20H21F3N4O7S2/c21-20(22,23)15-11-13(1-4-18(15)36(32,33)34)26-8-5-25(6-9-26)7-10-27-17-12-14(35(29,30)31)2-3-16(17)24-19(27)28/h1-4,11-12H,5-10H2,(H,24,28)(H,29,30,31)(H,32,33,34)

HIDE SMILES / InChI

Approval Year

Name Type Language
2-OXO-3-(2-(4-(4-SULFO-3-(TRIFLUOROMETHYL)PHENYL)PIPERAZIN-1-YL)ETHYL)-1H-BENZIMIDAZOLE-5-SULFONIC ACID
Systematic Name English
FLIBANSERIN METABOLITE M25
Common Name English
CD 11760 SE
Common Name English
Code System Code Type Description
FDA UNII
CT85K7JJ6H
Created by admin on Sat Dec 16 14:36:49 GMT 2023 , Edited by admin on Sat Dec 16 14:36:49 GMT 2023
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PUBCHEM
156613966
Created by admin on Sat Dec 16 14:36:49 GMT 2023 , Edited by admin on Sat Dec 16 14:36:49 GMT 2023
PRIMARY