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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H17ClFN5O2
Molecular Weight 389.811
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACT-774312

SMILES

CN([C@H]1CCC2=C(C1)C3=C(C=CC(F)=N3)N2CC(O)=O)C4=NC=C(Cl)C=N4

InChI

InChIKey=IKOFSSXNZQZRTE-NSHDSACASA-N
InChI=1S/C18H17ClFN5O2/c1-24(18-21-7-10(19)8-22-18)11-2-3-13-12(6-11)17-14(4-5-15(20)23-17)25(13)9-16(26)27/h4-5,7-8,11H,2-3,6,9H2,1H3,(H,26,27)/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H17ClFN5O2
Molecular Weight 389.811
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 21:23:36 GMT 2025
Edited
by admin
on Wed Apr 02 21:23:36 GMT 2025
Record UNII
ZV9R9THV2A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACT-774312
Common Name English
(8S)-8-[(5-Chloro-2-pyrimidinyl)methylamino]-2-fluoro-6,7,8,9-tetrahydro-5H-pyrido[3,2-b]indole-5-acetic acid
Preferred Name English
5H-Pyrido[3,2-b]indole-5-acetic acid, 8-[(5-chloro-2-pyrimidinyl)methylamino]-2-fluoro-6,7,8,9-tetrahydro-, (8S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
118385816
Created by admin on Wed Apr 02 21:23:36 GMT 2025 , Edited by admin on Wed Apr 02 21:23:36 GMT 2025
PRIMARY
NCI_THESAURUS
C161834
Created by admin on Wed Apr 02 21:23:36 GMT 2025 , Edited by admin on Wed Apr 02 21:23:36 GMT 2025
PRIMARY
CAS
1809863-68-0
Created by admin on Wed Apr 02 21:23:36 GMT 2025 , Edited by admin on Wed Apr 02 21:23:36 GMT 2025
PRIMARY
FDA UNII
ZV9R9THV2A
Created by admin on Wed Apr 02 21:23:36 GMT 2025 , Edited by admin on Wed Apr 02 21:23:36 GMT 2025
PRIMARY
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