ABEMACICLIB MESYLATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H32F2N8.CH4O3S
Molecular Weight	602.699
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CS(O)(=O)=O.CCN1CCN(CC2=CN=C(NC3=NC=C(F)C(=N3)C4=CC(F)=C5N=C(C)N(C(C)C)C5=C4)C=C2)CC1

InChI

InChIKey=NCJPFQPEVDHJAZ-UHFFFAOYSA-N

InChI=1S/C27H32F2N8.CH4O3S/c1-5-35-8-10-36(11-9-35)16-19-6-7-24(30-14-19)33-27-31-15-22(29)25(34-27)20-12-21(28)26-23(13-20)37(17(2)3)18(4)32-26;1-5(2,3)4/h6-7,12-15,17H,5,8-11,16H2,1-4H3,(H,30,31,33,34);1H3,(H,2,3,4)

HIDE SMILES / InChI

Molecular Formula	CH4O3S
Molecular Weight	96.106
Charge	0
Count

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

Molecular Formula	C27H32F2N8
Molecular Weight	506.5934
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 05:18:41 UTC 2023` Edited by `admin` on `Sat Dec 16 05:18:41 UTC 2023`
Record UNII	KKT462Q807
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ABEMACICLIB MESYLATE

Common Name

English

LY-2835219 METHANESULFONATE

Code

English

Abemaciclib mesilate [WHO-DD]

Common Name

English

ABEMACICLIB MESILATE

Common Name

English

2-PYRIMIDINAMINE, N-(5-((4-ETHYL-1-PIPERAZINYL)METHYL)-2-PYRIDINYL)-5-FLUORO-4-(4-FLUORO-2-METHYL-1-(1-METHYLETHYL)-1H-BENZIMIDAZOL-6-YL)-, METHANESULFONATE (1:1)

Systematic Name

English

Code System Code Type Description

NCI_THESAURUS

C162507