IMATINIB REGIOISOMER 2

Details

Stereochemistry	ACHIRAL
Molecular Formula	C29H31N7O
Molecular Weight	493.6027
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1CCN(CC2=CC=C(C=C2)C(=O)NC3=CC=CC(NC4=NC=CC(=N4)C5=CC=CN=C5)=C3C)CC1

InChI

InChIKey=KGWGJBYBPNYVNL-UHFFFAOYSA-N

InChI=1S/C29H31N7O/c1-21-25(32-28(37)23-10-8-22(9-11-23)20-36-17-15-35(2)16-18-36)6-3-7-26(21)33-29-31-14-12-27(34-29)24-5-4-13-30-19-24/h3-14,19H,15-18,20H2,1-2H3,(H,32,37)(H,31,33,34)

HIDE SMILES / InChI

Molecular Formula	C29H31N7O
Molecular Weight	493.6027
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 19:05:56 GMT 2023` Edited by `admin` on `Sat Dec 16 19:05:56 GMT 2023`
Record UNII	57WZ3S7R55
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

IMATINIB REGIOISOMER 2

Common Name

English

BENZAMIDE, 4-((4-METHYL-1-PIPERAZINYL)METHYL)-N-(2-METHYL-3-((4-(3-PYRIDINYL)-2-PYRIMIDINYL)AMINO)PHENYL)-

Systematic Name

English

4-((4-METHYL-1-PIPERAZINYL)METHYL)-N-(2-METHYL-3-((4-(3-PYRIDINYL)-2-PYRIMIDINYL)AMINO)PHENYL)BENZAMIDE

Systematic Name

English

Code System Code Type Description

PUBCHEM

69773668

Created by admin on Sat Dec 16 19:05:56 GMT 2023 , Edited by admin on Sat Dec 16 19:05:56 GMT 2023

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CAS

1349250-06-1

Created by admin on Sat Dec 16 19:05:56 GMT 2023 , Edited by admin on Sat Dec 16 19:05:56 GMT 2023

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FDA UNII

57WZ3S7R55

Created by admin on Sat Dec 16 19:05:56 GMT 2023 , Edited by admin on Sat Dec 16 19:05:56 GMT 2023

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