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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H18F2N2O3S
Molecular Weight 452.473
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-((11S)-7,8-DIFLUORO-6,11-DIHYDROBENZO(C)(1)BENZOTHIEPIN-11-YL)-5-HYDROXYSPIRO(2H-PYRIDO(1,2-B)PYRIDAZINE-3,1'-CYCLOPROPANE)-4,6-DIONE

SMILES

OC1=C2N(C=CC1=O)N(CC3(CC3)C2=O)[C@@H]4C5=CC=CC=C5SCC6=C(F)C(F)=CC=C46

InChI

InChIKey=LHLSUAYDUCYUTC-FQEVSTJZSA-N
InChI=1S/C24H18F2N2O3S/c25-16-6-5-13-15(19(16)26)11-32-18-4-2-1-3-14(18)20(13)28-12-24(8-9-24)23(31)21-22(30)17(29)7-10-27(21)28/h1-7,10,20,30H,8-9,11-12H2/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H18F2N2O3S
Molecular Weight 452.473
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 09:22:13 GMT 2025
Edited
by admin
on Wed Apr 02 09:22:13 GMT 2025
Record UNII
C1CIH3C1DH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SPIRO(CYCLOPROPANE-1,3'-(3H)PYRIDO(1,2-B)PYRIDAZINE)-4',6'-DIONE, 1'-((11S)-7,8-DIFLUORO-6,11-DIHYDRODIBENZO(B,E)THIEPIN-11-YL)-1',2'-DIHYDRO-5'-HYDROXY-
Preferred Name English
1-((11S)-7,8-DIFLUORO-6,11-DIHYDROBENZO(C)(1)BENZOTHIEPIN-11-YL)-5-HYDROXYSPIRO(2H-PYRIDO(1,2-B)PYRIDAZINE-3,1'-CYCLOPROPANE)-4,6-DIONE
Systematic Name English
Code System Code Type Description
PUBCHEM
146304678
Created by admin on Wed Apr 02 09:22:13 GMT 2025 , Edited by admin on Wed Apr 02 09:22:13 GMT 2025
PRIMARY
CAS
2408318-14-7
Created by admin on Wed Apr 02 09:22:13 GMT 2025 , Edited by admin on Wed Apr 02 09:22:13 GMT 2025
PRIMARY
FDA UNII
C1CIH3C1DH
Created by admin on Wed Apr 02 09:22:13 GMT 2025 , Edited by admin on Wed Apr 02 09:22:13 GMT 2025
PRIMARY
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