SARACATINIB DIFUMARATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H32ClN5O5.2C4H4O4
Molecular Weight	774.171
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)\C=C\C(O)=O.OC(=O)\C=C\C(O)=O.CN1CCN(CCOC2=CC(OC3CCOCC3)=C4C(NC5=C6OCOC6=CC=C5Cl)=NC=NC4=C2)CC1

InChI

InChIKey=OQXMMAQEMJUIQM-LVEZLNDCSA-N

InChI=1S/C27H32ClN5O5.2C4H4O4/c1-32-6-8-33(9-7-32)10-13-35-19-14-21-24(23(15-19)38-18-4-11-34-12-5-18)27(30-16-29-21)31-25-20(28)2-3-22-26(25)37-17-36-22;2*5-3(6)1-2-4(7)8/h2-3,14-16,18H,4-13,17H2,1H3,(H,29,30,31);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+

HIDE SMILES / InChI

Molecular Formula	C4H4O4
Molecular Weight	116.0722
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Molecular Formula	C27H32ClN5O5
Molecular Weight	542.026
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 `Fri Dec 15 15:56:24 UTC 2023` Edited by `admin` on `Fri Dec 15 15:56:24 UTC 2023`
Record UNII	8R1DYT4EAW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SARACATINIB DIFUMARATE

Official Name

English

4-QUINAZOLINAMINE, N-(5-CHLORO-1,3-BENZODIOXOL-4-YL)-7-(2-(4-METHYL-1-PIPERAZINYL)ETHOXY)-5-((TETRAHYDRO-2H-PYRAN-4-YL)OXY)-, (2E)-2-BUTENEDIOATE (1:2)

Common Name

English

N-(5-CHLORO-1,3-BENZODIOXOL-4-YL)-7-(2-(4-METHYLPIPERAZIN-1-YL)ETHOXY)-5-(TETRAHYDRO-2H-PYRAN-4-YLOXY)QUINAZOLIN-4-AMINE DI((2E)-BUT-2-ENEDIOATE)

Common Name

English

SARACATINIB FUMARATE

Common Name

English

SARACATINIB FUMARATE [JAN]

Common Name

English

AZD0530 DIFUMARATE

Code

English

Saracatinib difumarate [WHO-DD]

Common Name

English

SARACATINIB DIFUMARATE [USAN]

Common Name

English

AZD-0530 DIFUMARATE

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C129825