Evobrutinib

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H27N5O2
Molecular Weight	429.5142
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC1=C(C(NCC2CCN(CC2)C(=O)C=C)=NC=N1)C3=CC=C(OC4=CC=CC=C4)C=C3

InChI

InChIKey=QUIWHXQETADMGN-UHFFFAOYSA-N

InChI=1S/C25H27N5O2/c1-2-22(31)30-14-12-18(13-15-30)16-27-25-23(24(26)28-17-29-25)19-8-10-21(11-9-19)32-20-6-4-3-5-7-20/h2-11,17-18H,1,12-16H2,(H3,26,27,28,29)

HIDE SMILES / InChI

Molecular Formula	C25H27N5O2
Molecular Weight	429.5142
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 17:40:40 UTC 2023` Edited by `admin` on `Sat Dec 16 17:40:40 UTC 2023`
Record UNII	ZA45457L1K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Evobrutinib

Official Name

English

EVOBRUTINIB [USAN]

Common Name

English

2-Propen-1-one, 1-[4-[[[6-amino-5-(4-phenoxyphenyl)-4-pyrimidinyl]amino]methyl]-1-piperidinyl]-

Systematic Name

English

evobrutinib [INN]

Common Name

English

1-[4-[[[6-Amino-5-(4-phenoxyphenyl)-4-pyrimidinyl]amino]methyl]-1-piperidinyl]-2-propen-1-one

Systematic Name

English

MSC2364447C

Code

English

Evobrutinib [WHO-DD]

Common Name

English

M-2951

Code

English

MSC-2364447C

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C124801