BMS-748730

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H26ClN7O3S
Molecular Weight	504.005
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=NC(=CC(NC2=NC=C(S2)C(=O)NC3=C(C)C=C(O)C=C3Cl)=N1)N4CCN(CCO)CC4

InChI

InChIKey=YYTXGSVGHHVHNZ-UHFFFAOYSA-N

InChI=1S/C22H26ClN7O3S/c1-13-9-15(32)10-16(23)20(13)28-21(33)17-12-24-22(34-17)27-18-11-19(26-14(2)25-18)30-5-3-29(4-6-30)7-8-31/h9-12,31-32H,3-8H2,1-2H3,(H,28,33)(H,24,25,26,27)

HIDE SMILES / InChI

Molecular Formula	C22H26ClN7O3S
Molecular Weight	504.005
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:23:55 GMT 2025` Edited by `admin` on `Mon Mar 31 21:23:55 GMT 2025`
Record UNII	7EW75J44EY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DASATINIB METABOLITE M20

Preferred Name

English

BMS-748730

Common Name

English

N-(2-CHLORO-4-HYDROXY-6-METHYL-PHENYL)-2-((6-(4-(2-HYDROXYETHYL)PIPERAZIN-1-YL)-2-METHYL-PYRIMIDIN-4-YL)AMINO)THIAZOLE-5-CARBOXAMIDE

Systematic Name

English

5-THIAZOLECARBOXAMIDE, N-(2-CHLORO-4-HYDROXY-6-METHYLPHENYL)-2-((6-(4-(2-HYDROXYETHYL)-1-PIPERAZINYL)-2-METHYL-4-PYRIMIDINYL)AMINO)-

Systematic Name

English

Code System Code Type Description

SMS_ID

300000008020