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Details

Stereochemistry ACHIRAL
Molecular Formula C29H31N7O2
Molecular Weight 509.6021
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Imatinib (Piperazine)-N1-Oxide

SMILES

CN1CC[N+]([O-])(CC2=CC=C(C=C2)C(=O)NC3=CC=C(C)C(NC4=NC=CC(=N4)C5=CN=CC=C5)=C3)CC1

InChI

InChIKey=JOLLULXEPUYESM-UHFFFAOYSA-N
InChI=1S/C29H31N7O2/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36(38)16-14-35(2)15-17-36/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34)

HIDE SMILES / InChI

Approval Year

Name Type Language
Imatinib (Piperazine)-N1-Oxide
Common Name English
Imatinib Piperazine-N4-Oxide
Common Name English
Imatinib Impurity C
Common Name English
Benzamide, 4-[(4-methyl-1-oxido-1-piperazinyl)methyl]-N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-
Systematic Name English
4-[(4-Methyl-1-oxido-1-piperazinyl)methyl]-N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]benzamide
Systematic Name English
Code System Code Type Description
CAS
938082-57-6
Created by admin on Sat Dec 16 19:36:38 GMT 2023 , Edited by admin on Sat Dec 16 19:36:38 GMT 2023
PRIMARY
PUBCHEM
71749456
Created by admin on Sat Dec 16 19:36:38 GMT 2023 , Edited by admin on Sat Dec 16 19:36:38 GMT 2023
PRIMARY
FDA UNII
AA66Z5QJ8H
Created by admin on Sat Dec 16 19:36:38 GMT 2023 , Edited by admin on Sat Dec 16 19:36:38 GMT 2023
PRIMARY