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

Details

Stereochemistry ACHIRAL
Molecular Formula C32H29N5O2.ClH
Molecular Weight 552.066
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ENZASTAURIN HYDROCHLORIDE

SMILES

Cl.CN1C=C(C2=C1C=CC=C2)C3=C(C(=O)NC3=O)C4=CN(C5CCN(CC6=CC=CC=N6)CC5)C7=CC=CC=C47

InChI

InChIKey=UUADYKVKJIMIPA-UHFFFAOYSA-N
InChI=1S/C32H29N5O2.ClH/c1-35-19-25(23-9-2-4-11-27(23)35)29-30(32(39)34-31(29)38)26-20-37(28-12-5-3-10-24(26)28)22-13-16-36(17-14-22)18-21-8-6-7-15-33-21;/h2-12,15,19-20,22H,13-14,16-18H2,1H3,(H,34,38,39);1H

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 C32H29N5O2
Molecular Weight 515.605
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 15:46:46 UTC 2023
Edited
by admin
on Fri Dec 15 15:46:46 UTC 2023
Record UNII
KX7K68Z2UH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ENZASTAURIN HYDROCHLORIDE
MART.   MI   USAN  
USAN  
Official Name English
Enzastaurin monohydrochloride [WHO-DD]
Common Name English
1H-PYRROLE-2,5-DIONE, 3-(1-METHYL-1H-INDOL-3-YL)-4-(1-(1-(2-PYRIDINYLMETHYL)-4-PIPERIDINYL)-1H-INDOL-3-YL)-, MONOHYDROCHLORIDE
Common Name English
ENZASTAURIN HYDROCHLORIDE [MART.]
Common Name English
ENZASTAURIN HCL
Common Name English
3-(1-METHYL-1H-INDOL-3-YL)-4-(1-(1-(2-PYRIDINYLMETHYL)-4-PIPERIDINYL)-1H-INDOL-3-YL)-1H-PYRROLE-2,5-DIONE HYDROCHLORIDE
Systematic Name English
3-(1-Methyl-1H-indol-3-yl)-4-[1-[1-(pyridin-2-ylmethyl)piperidin-4-yl]-1H-indol-3-yl]-1H-pyrrole-2,5-dione monohydrochloride
Systematic Name English
LY317615 HYDROCHLORIDE
Code English
ENZASTAURIN HYDROCHLORIDE [JAN]
Common Name English
ENZASTAURIN MONOHYDROCHLORIDE
WHO-DD  
Common Name English
ENZASTAURIN HYDROCHLORIDE [MI]
Common Name English
ENZASTAURIN HYDROCHLORIDE [USAN]
Common Name English
LY-317615 HYDROCHLORIDE
Code English
Classification Tree Code System Code
NCI_THESAURUS C2089
Created by admin on Fri Dec 15 15:46:46 UTC 2023 , Edited by admin on Fri Dec 15 15:46:46 UTC 2023
EU-Orphan Drug EU/3/07/442
Created by admin on Fri Dec 15 15:46:46 UTC 2023 , Edited by admin on Fri Dec 15 15:46:46 UTC 2023
Code System Code Type Description
CAS
359017-79-1
Created by admin on Fri Dec 15 15:46:46 UTC 2023 , Edited by admin on Fri Dec 15 15:46:46 UTC 2023
PRIMARY
SMS_ID
100000163610
Created by admin on Fri Dec 15 15:46:46 UTC 2023 , Edited by admin on Fri Dec 15 15:46:46 UTC 2023
PRIMARY
FDA UNII
KX7K68Z2UH
Created by admin on Fri Dec 15 15:46:46 UTC 2023 , Edited by admin on Fri Dec 15 15:46:46 UTC 2023
PRIMARY
ChEMBL
CHEMBL300138
Created by admin on Fri Dec 15 15:46:46 UTC 2023 , Edited by admin on Fri Dec 15 15:46:46 UTC 2023
PRIMARY
MERCK INDEX
m4926
Created by admin on Fri Dec 15 15:46:46 UTC 2023 , Edited by admin on Fri Dec 15 15:46:46 UTC 2023
PRIMARY Merck Index
PUBCHEM
176166
Created by admin on Fri Dec 15 15:46:46 UTC 2023 , Edited by admin on Fri Dec 15 15:46:46 UTC 2023
PRIMARY
EPA CompTox
DTXSID70189477
Created by admin on Fri Dec 15 15:46:46 UTC 2023 , Edited by admin on Fri Dec 15 15:46:46 UTC 2023
PRIMARY
DRUG BANK
DBSALT002020
Created by admin on Fri Dec 15 15:46:46 UTC 2023 , Edited by admin on Fri Dec 15 15:46:46 UTC 2023
PRIMARY
EVMPD
SUB177929
Created by admin on Fri Dec 15 15:46:46 UTC 2023 , Edited by admin on Fri Dec 15 15:46:46 UTC 2023
PRIMARY
USAN
OO-15
Created by admin on Fri Dec 15 15:46:46 UTC 2023 , Edited by admin on Fri Dec 15 15:46:46 UTC 2023
PRIMARY
NCI_THESAURUS
C26658
Created by admin on Fri Dec 15 15:46:46 UTC 2023 , Edited by admin on Fri Dec 15 15:46:46 UTC 2023
PRIMARY
Related Record Type Details
SOLVATE->ANHYDROUS
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY