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

Details

Stereochemistry ACHIRAL
Molecular Formula C26H33N5O2
Molecular Weight 447.5725
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NILPRAZOLE

SMILES

CC(C)NC(=O)CN1CCN(CC2=NC3=CC=CC=C3N2CCC(=O)C4=CC=CC=C4)CC1

InChI

InChIKey=GPFJNGJUUKBSLS-UHFFFAOYSA-N
InChI=1S/C26H33N5O2/c1-20(2)27-26(33)19-30-16-14-29(15-17-30)18-25-28-22-10-6-7-11-23(22)31(25)13-12-24(32)21-8-4-3-5-9-21/h3-11,20H,12-19H2,1-2H3,(H,27,33)

HIDE SMILES / InChI
Name Type Language
NILPRAZOLE
INN  
INN  
Official Name English
nilprazole [INN]
Common Name English
4-((1-(2-BENZOYLETHYL)-2-BENZIMIDAZOLYL)METHYL)-N-ISOPROPYL-1-PIPERAZINEACETAMIDE
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C29723
Created by admin on Sat Dec 16 16:31:29 GMT 2023 , Edited by admin on Sat Dec 16 16:31:29 GMT 2023
Code System Code Type Description
FDA UNII
AET4M101U3
Created by admin on Sat Dec 16 16:31:29 GMT 2023 , Edited by admin on Sat Dec 16 16:31:29 GMT 2023
PRIMARY
CAS
60662-19-3
Created by admin on Sat Dec 16 16:31:29 GMT 2023 , Edited by admin on Sat Dec 16 16:31:29 GMT 2023
PRIMARY
EVMPD
SUB09289MIG
Created by admin on Sat Dec 16 16:31:29 GMT 2023 , Edited by admin on Sat Dec 16 16:31:29 GMT 2023
PRIMARY
SMS_ID
100000083882
Created by admin on Sat Dec 16 16:31:29 GMT 2023 , Edited by admin on Sat Dec 16 16:31:29 GMT 2023
PRIMARY
EPA CompTox
DTXSID80209473
Created by admin on Sat Dec 16 16:31:29 GMT 2023 , Edited by admin on Sat Dec 16 16:31:29 GMT 2023
PRIMARY
PUBCHEM
71956
Created by admin on Sat Dec 16 16:31:29 GMT 2023 , Edited by admin on Sat Dec 16 16:31:29 GMT 2023
PRIMARY
ECHA (EC/EINECS)
262-354-4
Created by admin on Sat Dec 16 16:31:29 GMT 2023 , Edited by admin on Sat Dec 16 16:31:29 GMT 2023
PRIMARY
INN
4251
Created by admin on Sat Dec 16 16:31:29 GMT 2023 , Edited by admin on Sat Dec 16 16:31:29 GMT 2023
PRIMARY
NCI_THESAURUS
C76912
Created by admin on Sat Dec 16 16:31:29 GMT 2023 , Edited by admin on Sat Dec 16 16:31:29 GMT 2023
PRIMARY
ChEMBL
CHEMBL2104513
Created by admin on Sat Dec 16 16:31:29 GMT 2023 , Edited by admin on Sat Dec 16 16:31:29 GMT 2023
PRIMARY