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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H26FN7O3S2
Molecular Weight 555.647
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZAVACORILANT

SMILES

[H][C@@]12CCN(C[C@]1(CC3=C(C2)N(N=C3)C4=CC=C(F)C=C4)C(=O)C5=CSC=N5)S(=O)(=O)C6=NN(N=C6)C(C)C

InChI

InChIKey=DUHWKWNCLIALLV-BVZFJXPGSA-N
InChI=1S/C25H26FN7O3S2/c1-16(2)33-29-12-23(30-33)38(35,36)31-8-7-18-9-22-17(11-28-32(22)20-5-3-19(26)4-6-20)10-25(18,14-31)24(34)21-13-37-15-27-21/h3-6,11-13,15-16,18H,7-10,14H2,1-2H3/t18-,25-/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H26FN7O3S2
Molecular Weight 555.647
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 23:44:25 UTC 2023
Edited
by admin
on Thu Jul 06 23:44:25 UTC 2023
Record UNII
74XPH8W9F6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ZAVACORILANT
INN  
Official Name English
((4AR,8AS)-1-(4-FLUOROPHENYL)-1,4,5,6,7,8,8A,9-OCTAHYDRO-6-((2-(1-METHYLETHYL)-2H-1,2,3-TRIAZOL-4-YL)SULFONYL)-4AH-PYRAZOLO(3,4-G)ISOQUINOLIN-4A-YL)-4-THIAZOLYLMETHANONE
Systematic Name English
zavacorilant [INN]
Common Name English
METHANONE, ((4AR,8AS)-1-(4-FLUOROPHENYL)-1,4,5,6,7,8,8A,9-OCTAHYDRO-6-((2-(1-METHYLETHYL)-2H-1,2,3-TRIAZOL-4-YL)SULFONYL)-4AH-PYRAZOLO(3,4-G)ISOQUINOLIN-4A-YL)-4-THIAZOLYL-
Systematic Name English
Code System Code Type Description
NCI_THESAURUS
C184845
Created by admin on Thu Jul 06 23:44:25 UTC 2023 , Edited by admin on Thu Jul 06 23:44:25 UTC 2023
PRIMARY
SMS_ID
300000039032
Created by admin on Thu Jul 06 23:44:25 UTC 2023 , Edited by admin on Thu Jul 06 23:44:25 UTC 2023
PRIMARY
CAS
1781245-13-3
Created by admin on Thu Jul 06 23:44:25 UTC 2023 , Edited by admin on Thu Jul 06 23:44:25 UTC 2023
PRIMARY
PUBCHEM
118092352
Created by admin on Thu Jul 06 23:44:25 UTC 2023 , Edited by admin on Thu Jul 06 23:44:25 UTC 2023
PRIMARY
FDA UNII
74XPH8W9F6
Created by admin on Thu Jul 06 23:44:25 UTC 2023 , Edited by admin on Thu Jul 06 23:44:25 UTC 2023
PRIMARY
INN
11759
Created by admin on Thu Jul 06 23:44:25 UTC 2023 , Edited by admin on Thu Jul 06 23:44:25 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
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ACTIVE MOIETY