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Details

Stereochemistry ACHIRAL
Molecular Formula C22H23N3O3S
Molecular Weight 409.5032
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CERLAPIRDINE

SMILES

CN(C)CCCOc1ccc2c(c1)c(n[nH]2)S(=O)(=O)c3cccc4ccccc43

InChI

InChIKey=NXQGEDVQXVTCDA-UHFFFAOYSA-N
InChI=1S/C22H23N3O3S/c1-25(2)13-6-14-28-17-11-12-20-19(15-17)22(24-23-20)29(26,27)21-10-5-8-16-7-3-4-9-18(16)21/h3-5,7-12,15H,6,13-14H2,1-2H3,(H,23,24)

HIDE SMILES / InChI

Molecular Formula C22H23N3O3S
Molecular Weight 409.5032
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

PubMed

PubMed

TitleDatePubMed
Patents

Sample Use Guides

5-mg/day
Route of Administration: Oral
Substance Class Chemical
Created
by admin
on Sat Jun 26 07:00:48 UTC 2021
Edited
by admin
on Sat Jun 26 07:00:48 UTC 2021
Record UNII
EK40PJ0V49
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CERLAPIRDINE
INN   USAN   WHO-DD  
INN   USAN  
Official Name English
WAY-262,531
Code English
SAM-531
Code English
SAM-531 FREE BASE
Code English
CERLAPIRDINE [WHO-DD]
Common Name English
CERLAPIRDINE [USAN]
Common Name English
WAY-262531
Code English
PF-05212365
Code English
N,N-DIMETHYL-3-((3-(1-NAPHTHYLSULFONYL)-1H-INDAZOL-5-YL)OXY)PROPAN-1-AMINE
Systematic Name English
N,N-DIMETHYL-3-((3-((NAPHTHALEN-1-YL)SULFONYL)-1H-INDAZOL-5-YL)OXY)PROPAN-1-AMINE
Systematic Name English
CERLAPIRDINE [INN]
Common Name English
1-PROPANAMINE, N,N-DIMETHYL-3-((3-(1-NAPHTHALENYLSULFONYL)-1H-INDAZOL-5-YL)OXY)-
Systematic Name English
Code System Code Type Description
FDA UNII
EK40PJ0V49
Created by admin on Sat Jun 26 07:00:48 UTC 2021 , Edited by admin on Sat Jun 26 07:00:48 UTC 2021
PRIMARY
INN
9553
Created by admin on Sat Jun 26 07:00:48 UTC 2021 , Edited by admin on Sat Jun 26 07:00:48 UTC 2021
PRIMARY
NCI_THESAURUS
C169839
Created by admin on Sat Jun 26 07:00:48 UTC 2021 , Edited by admin on Sat Jun 26 07:00:48 UTC 2021
PRIMARY
CAS
925448-93-7
Created by admin on Sat Jun 26 07:00:48 UTC 2021 , Edited by admin on Sat Jun 26 07:00:48 UTC 2021
PRIMARY
ChEMBL
CHEMBL2103880
Created by admin on Sat Jun 26 07:00:48 UTC 2021 , Edited by admin on Sat Jun 26 07:00:48 UTC 2021
PRIMARY
EVMPD
SUB178433
Created by admin on Sat Jun 26 07:00:48 UTC 2021 , Edited by admin on Sat Jun 26 07:00:48 UTC 2021
PRIMARY
PUBCHEM
16071605
Created by admin on Sat Jun 26 07:00:48 UTC 2021 , Edited by admin on Sat Jun 26 07:00:48 UTC 2021
PRIMARY
DRUG BANK
DB12229
Created by admin on Sat Jun 26 07:00:48 UTC 2021 , Edited by admin on Sat Jun 26 07:00:48 UTC 2021
PRIMARY
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EXCRETED UNCHANGED
AMOUNT EXCRETED
URINE
EXCRETED UNCHANGED
AMOUNT EXCRETED
FECAL
SALT/SOLVATE -> PARENT
METABOLIC ENZYME -> SUBSTRATE
MAJOR
METABOLIC ENZYME -> SUBSTRATE
TARGET->ANTAGONIST
Related Record Type Details
METABOLITE -> PARENT
URINE
Related Record Type Details
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
Tmax PHARMACOKINETIC ORAL ADMINISTRATION

SINGLE DOSE

Biological Half-life PHARMACOKINETIC SINGLE DOSE

ORAL ADMINISTRATION