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Details

Stereochemistry ACHIRAL
Molecular Formula C32H46N4O4
Molecular Weight 550.732
Optical Activity NONE
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Igermetostat

SMILES

CCN(C1CCOCC1)C2=C(C)C(=CC(O[C@H]3C[C@@H](C3)N4CCCCC4)=C2)C(=O)NCC5=C(C)C=C(C)NC5=O

InChI

InChIKey=YGNGDDWFJFOIGX-DIVCQZSQSA-N
InChI=1S/C32H46N4O4/c1-5-36(24-9-13-39-14-10-24)30-19-27(40-26-16-25(17-26)35-11-7-6-8-12-35)18-28(23(30)4)31(37)33-20-29-21(2)15-22(3)34-32(29)38/h15,18-19,24-26H,5-14,16-17,20H2,1-4H3,(H,33,37)(H,34,38)/t25-,26-

HIDE SMILES / InChI

Molecular Formula C32H46N4O4
Molecular Weight 550.732
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 Sat Dec 16 19:57:05 UTC 2023
Edited
by admin
on Sat Dec 16 19:57:05 UTC 2023
Record UNII
2KES6YSH8D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Igermetostat
INN  
Official Name English
Igermetostat [INN]
Common Name English
Benzamide, N-[(1,2-dihydro-4,6-dimethyl-2-oxo-3-pyridinyl)methyl]-3-[ethyl(tetrahydro-2H-pyran-4-yl)amino]-2-methyl-5-[[trans-3-(1-piperidinyl)cyclobutyl]oxy]-
Systematic Name English
N-[(4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methyl]-3-[ethyl(oxan-4-yl)amino]-2-methyl-5-{[(1r,3r)-3-(piperidin-1-yl)cyclobutyl]oxy}benzamide
Systematic Name English
N-[(1,2-Dihydro-4,6-dimethyl-2-oxo-3-pyridinyl)methyl]-3-[ethyl(tetrahydro-2H-pyran-4-yl)amino]-2-methyl-5-[[trans-3-(1-piperidinyl)cyclobutyl]oxy]benzamide
Systematic Name English
Code System Code Type Description
FDA UNII
2KES6YSH8D
Created by admin on Sat Dec 16 19:57:05 UTC 2023 , Edited by admin on Sat Dec 16 19:57:05 UTC 2023
PRIMARY
INN
12655
Created by admin on Sat Dec 16 19:57:05 UTC 2023 , Edited by admin on Sat Dec 16 19:57:05 UTC 2023
PRIMARY
CAS
2409538-60-7
Created by admin on Sat Dec 16 19:57:05 UTC 2023 , Edited by admin on Sat Dec 16 19:57:05 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY