2,2′-[1,4-piperazinediylbis[(2-methyl-6,4-pyrimidinediyl)imino]]bis[N-(2-chloro-6-methylphenyl)-5-Thiazolecarboxamide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C36H34Cl2N12O2S2
Molecular Weight	801.77
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,2′-[1,4-piperazinediylbis[(2-methyl-6,4-pyrimidinediyl)imino]]bis[N-(2-chloro-6-methylphenyl)-5-Thiazolecarboxamide

Structure Search

SMILES

CC1=NC(NC2=NC=C(S2)C(=O)NC3=C(C)C=CC=C3Cl)=CC(=N1)N4CCN(CC4)C5=NC(C)=NC(NC6=NC=C(S6)C(=O)NC7=C(C)C=CC=C7Cl)=C5

InChI

InChIKey=QBKZXQDFDIASAL-UHFFFAOYSA-N

InChI=1S/C36H34Cl2N12O2S2/c1-19-7-5-9-23(37)31(19)47-33(51)25-17-39-35(53-25)45-27-15-29(43-21(3)41-27)49-11-13-50(14-12-49)30-16-28(42-22(4)44-30)46-36-40-18-26(54-36)34(52)48-32-20(2)8-6-10-24(32)38/h5-10,15-18H,11-14H2,1-4H3,(H,47,51)(H,48,52)(H,39,41,43,45)(H,40,42,44,46)

HIDE SMILES / InChI

Molecular Formula	C36H34Cl2N12O2S2
Molecular Weight	801.77
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 18:49:48 GMT 2023` Edited by `admin` on `Sat Dec 16 18:49:48 GMT 2023`
Record UNII	KN4MSL5V2C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,2′-[1,4-piperazinediylbis[(2-methyl-6,4-pyrimidinediyl)imino]]bis[N-(2-chloro-6-methylphenyl)-5-Thiazolecarboxamide

Systematic Name

English

Dasatinib Dimeric Impurity

Common Name

English

5-Thiazolecarboxamide, 2,2′-[1,4-piperazinediylbis[(2-methyl-6,4-pyrimidinediyl)imino]]bis[N-(2-chloro-6-methylphenyl)-

Systematic Name

English

Code System Code Type Description

CAS

910297-61-9

Created by admin on Sat Dec 16 18:49:48 GMT 2023 , Edited by admin on Sat Dec 16 18:49:48 GMT 2023

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PUBCHEM

57940724

Created by admin on Sat Dec 16 18:49:48 GMT 2023 , Edited by admin on Sat Dec 16 18:49:48 GMT 2023

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FDA UNII

KN4MSL5V2C

Created by admin on Sat Dec 16 18:49:48 GMT 2023 , Edited by admin on Sat Dec 16 18:49:48 GMT 2023

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