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Details

Stereochemistry ACHIRAL
Molecular Formula C19H16N6O
Molecular Weight 344.3699
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-[2-[(4-Aminophenyl)amino]-4-pyrimidinyl]-N-(cyanomethyl)benzamide

SMILES

NC1=CC=C(NC2=NC=CC(=N2)C3=CC=C(C=C3)C(=O)NCC#N)C=C1

InChI

InChIKey=IAOCNVXPAVHLPY-UHFFFAOYSA-N
InChI=1S/C19H16N6O/c20-10-12-22-18(26)14-3-1-13(2-4-14)17-9-11-23-19(25-17)24-16-7-5-15(21)6-8-16/h1-9,11H,12,21H2,(H,22,26)(H,23,24,25)

HIDE SMILES / InChI

Molecular Formula C19H16N6O
Molecular Weight 344.3699
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 Sat Dec 16 15:40:34 GMT 2023
Edited
by admin
on Sat Dec 16 15:40:34 GMT 2023
Record UNII
D3N4Z27FYS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-[2-[(4-Aminophenyl)amino]-4-pyrimidinyl]-N-(cyanomethyl)benzamide
Systematic Name English
Benzamide, 4-[2-[(4-aminophenyl)amino]-4-pyrimidinyl]-N-(cyanomethyl)-
Systematic Name English
MOMELOTINIB METABOLITE M17
Common Name English
Code System Code Type Description
CAS
1841094-21-0
Created by admin on Sat Dec 16 15:40:35 GMT 2023 , Edited by admin on Sat Dec 16 15:40:35 GMT 2023
PRIMARY
FDA UNII
D3N4Z27FYS
Created by admin on Sat Dec 16 15:40:35 GMT 2023 , Edited by admin on Sat Dec 16 15:40:35 GMT 2023
PRIMARY
PUBCHEM
118574361
Created by admin on Sat Dec 16 15:40:35 GMT 2023 , Edited by admin on Sat Dec 16 15:40:35 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE