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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H31N3O2
Molecular Weight 369.5004
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PIBOSEROD

SMILES

CCCCN1CCC(CNC(=O)C2=C3OCCCN3C4=C2C=CC=C4)CC1

InChI

InChIKey=KVCSJPATKXABRQ-UHFFFAOYSA-N
InChI=1S/C22H31N3O2/c1-2-3-11-24-13-9-17(10-14-24)16-23-21(26)20-18-7-4-5-8-19(18)25-12-6-15-27-22(20)25/h4-5,7-8,17H,2-3,6,9-16H2,1H3,(H,23,26)

HIDE SMILES / InChI

Molecular Formula C22H31N3O2
Molecular Weight 369.5004
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:39:11 UTC 2023
Edited
by admin
on Fri Dec 15 15:39:11 UTC 2023
Record UNII
4UQ3S81B25
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PIBOSEROD
INN   MI   WHO-DD  
INN  
Official Name English
piboserod [INN]
Common Name English
N-((1-BUTYL-4-PIPERIDYL)METHYL)-3,4-DIHYDRO-2H-(1,3)OXAZINO(3,2-A)INDOLE-10-CARBOXAMIDE
Systematic Name English
2H-(1,3)OXAZINO(3,2-A)INDOLE-10-CARBOXAMIDE, N-((1-BUTYL-4-PIPERIDINYL)METHYL)-3,4-DIHYDRO-
Systematic Name English
Piboserod [WHO-DD]
Common Name English
PIBOSEROD [MI]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C66885
Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023
Code System Code Type Description
NCI_THESAURUS
C74393
Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023
PRIMARY
FDA UNII
4UQ3S81B25
Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023
PRIMARY
MESH
C479132
Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023
PRIMARY
DRUG BANK
DB04873
Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023
PRIMARY
SMS_ID
100000086544
Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023
PRIMARY
WIKIPEDIA
PIBOSEROD
Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023
PRIMARY
CAS
152811-62-6
Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023
PRIMARY
EPA CompTox
DTXSID60165129
Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023
PRIMARY
INN
7587
Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023
PRIMARY
ChEMBL
CHEMBL356359
Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023
PRIMARY
EVMPD
SUB22654
Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023
PRIMARY
MERCK INDEX
m8775
Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023
PRIMARY Merck Index
PUBCHEM
177336
Created by admin on Fri Dec 15 15:39:11 UTC 2023 , Edited by admin on Fri Dec 15 15:39:11 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY