U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H22N2O2.ClH
Molecular Weight 418.915
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TALNETANT HYDROCHLORIDE

SMILES

Cl.CC[C@H](NC(=O)C1=C(O)C(=NC2=C1C=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChIKey=BHCSUEHQURQVLD-BDQAORGHSA-N
InChI=1S/C25H22N2O2.ClH/c1-2-20(17-11-5-3-6-12-17)27-25(29)22-19-15-9-10-16-21(19)26-23(24(22)28)18-13-7-4-8-14-18;/h3-16,20,28H,2H2,1H3,(H,27,29);1H/t20-;/m0./s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C25H22N2O2
Molecular Weight 382.4544
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 Fri Dec 15 15:59:19 UTC 2023
Edited
by admin
on Fri Dec 15 15:59:19 UTC 2023
Record UNII
C1ZIJ8F59E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TALNETANT HYDROCHLORIDE
USAN   WHO-DD  
USAN  
Official Name English
Talnetant hydrochloride [WHO-DD]
Common Name English
TALNETANT HYDROCHLORIDE [USAN]
Common Name English
(S)-3-HYDROXY-2-PHENYL-N-(1-PHENYLPROPYL)-4-QUINOLINECARBOXAMIDE MONOHYDROCHLORIDE
Systematic Name English
SB-223412-A
Code English
Classification Tree Code System Code
NCI_THESAURUS C29698
Created by admin on Fri Dec 15 15:59:20 UTC 2023 , Edited by admin on Fri Dec 15 15:59:20 UTC 2023
Code System Code Type Description
ChEMBL
CHEMBL10188
Created by admin on Fri Dec 15 15:59:20 UTC 2023 , Edited by admin on Fri Dec 15 15:59:20 UTC 2023
PRIMARY
DRUG BANK
DBSALT002012
Created by admin on Fri Dec 15 15:59:20 UTC 2023 , Edited by admin on Fri Dec 15 15:59:20 UTC 2023
PRIMARY
FDA UNII
C1ZIJ8F59E
Created by admin on Fri Dec 15 15:59:20 UTC 2023 , Edited by admin on Fri Dec 15 15:59:20 UTC 2023
PRIMARY
CAS
204519-66-4
Created by admin on Fri Dec 15 15:59:20 UTC 2023 , Edited by admin on Fri Dec 15 15:59:20 UTC 2023
PRIMARY
PUBCHEM
9844955
Created by admin on Fri Dec 15 15:59:20 UTC 2023 , Edited by admin on Fri Dec 15 15:59:20 UTC 2023
PRIMARY
EPA CompTox
DTXSID50942628
Created by admin on Fri Dec 15 15:59:20 UTC 2023 , Edited by admin on Fri Dec 15 15:59:20 UTC 2023
PRIMARY
USAN
KK-81
Created by admin on Fri Dec 15 15:59:20 UTC 2023 , Edited by admin on Fri Dec 15 15:59:20 UTC 2023
PRIMARY
NCI_THESAURUS
C152498
Created by admin on Fri Dec 15 15:59:20 UTC 2023 , Edited by admin on Fri Dec 15 15:59:20 UTC 2023
PRIMARY
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