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Details

Stereochemistry EPIMERIC
Molecular Formula C37H42F2N8O4
Molecular Weight 700.7774
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (5S)-N-[4-[4-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-5-ethyl-6-methyl-5,6-dihydro-1,3,4-oxadiazine-4-carboxamide

SMILES

CC[C@H]1C(C)OC=NN1C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(OC[C@@H]5CO[C@](CN6C=NC=N6)(C5)C7=C(F)C=C(F)C=C7)C=C4

InChI

InChIKey=RIPRBAJKMRCEEY-SNECAYJWSA-N
InChI=1S/C37H42F2N8O4/c1-3-35-26(2)50-25-42-47(35)36(48)43-29-5-7-30(8-6-29)44-14-16-45(17-15-44)31-9-11-32(12-10-31)49-20-27-19-37(51-21-27,22-46-24-40-23-41-46)33-13-4-28(38)18-34(33)39/h4-13,18,23-27,35H,3,14-17,19-22H2,1-2H3,(H,43,48)/t26?,27-,35+,37+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
(5S)-N-[4-[4-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-5-ethyl-6-methyl-5,6-dihydro-1,3,4-oxadiazine-4-carboxamide
Preferred Name English
Code System Code Type Description
CAS
3036253-40-1
Created by admin on Wed Apr 02 20:20:42 GMT 2025 , Edited by admin on Wed Apr 02 20:20:42 GMT 2025
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PUBCHEM
171061670
Created by admin on Wed Apr 02 20:20:42 GMT 2025 , Edited by admin on Wed Apr 02 20:20:42 GMT 2025
PRIMARY
FDA UNII
FH52EM7PUT
Created by admin on Wed Apr 02 20:20:42 GMT 2025 , Edited by admin on Wed Apr 02 20:20:42 GMT 2025
PRIMARY