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

Details

Stereochemistry ABSOLUTE
Molecular Formula C28H36N6O2S
Molecular Weight 520.689
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Vopimetostat

SMILES

CCC1=CC(NC(=O)C(=O)N2C[C@@H](C)CC[C@@H]2C3=CC=C4SC(=NC4=C3)C5CCN(C)CC5)=CN=C1N

InChI

InChIKey=DHAGMIPSRSPWSH-GAJHUEQPSA-N
InChI=1S/C28H36N6O2S/c1-4-18-13-21(15-30-25(18)29)31-26(35)28(36)34-16-17(2)5-7-23(34)20-6-8-24-22(14-20)32-27(37-24)19-9-11-33(3)12-10-19/h6,8,13-15,17,19,23H,4-5,7,9-12,16H2,1-3H3,(H2,29,30)(H,31,35)/t17-,23+/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H36N6O2S
Molecular Weight 520.689
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 15:11:44 GMT 2025
Edited
by admin
on Wed Apr 02 15:11:44 GMT 2025
Record UNII
54P82QYL4L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Vopimetostat
INN  
Official Name English
vopimetostat [INN]
Preferred Name English
N-(6-Amino-5-ethylpyridin-3-yl)-2-{(2R,5S)-5-methyl-2-[2-(1-methylpiperidin-4-yl)-1,3-benzothiazol-5-yl]piperidin-1-yl}-2-oxoacetamide
Systematic Name English
1-Piperidineacetamide, N-(6-amino-5-ethyl-3-pyridinyl)-5-methyl-2-[2-(1-methyl-4-piperidinyl)-5-benzothiazolyl]-?-oxo-, (2R,5S)-
Systematic Name English
(2R,5S)-N-(6-Amino-5-ethyl-3-pyridinyl)-5-methyl-2-[2-(1-methyl-4-piperidinyl)-5-benzothiazolyl]-?-oxo-1-piperidineacetamide
Systematic Name English
Code System Code Type Description
PUBCHEM
164752829
Created by admin on Wed Apr 02 15:11:44 GMT 2025 , Edited by admin on Wed Apr 02 15:11:44 GMT 2025
PRIMARY
FDA UNII
54P82QYL4L
Created by admin on Wed Apr 02 15:11:44 GMT 2025 , Edited by admin on Wed Apr 02 15:11:44 GMT 2025
PRIMARY
CAS
2760483-96-1
Created by admin on Wed Apr 02 15:11:44 GMT 2025 , Edited by admin on Wed Apr 02 15:11:44 GMT 2025
PRIMARY
INN
13508
Created by admin on Wed Apr 02 15:11:44 GMT 2025 , Edited by admin on Wed Apr 02 15:11:44 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY