Sofnobrutinib

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H23FN8O2
Molecular Weight	498.5116
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1C=C(NC2=NC(=NC(N)=N2)C3=C(CO)C(=CC=C3)N4C=CC5=C(C(F)=CC(=C5)C6CC6)C4=O)C=N1

InChI

InChIKey=RQYDQAPLARKISN-UHFFFAOYSA-N

InChI=1S/C26H23FN8O2/c1-34-12-17(11-29-34)30-26-32-23(31-25(28)33-26)18-3-2-4-21(19(18)13-36)35-8-7-15-9-16(14-5-6-14)10-20(27)22(15)24(35)37/h2-4,7-12,14,36H,5-6,13H2,1H3,(H3,28,30,31,32,33)

HIDE SMILES / InChI

Approval Year

Name

Type

Language

AS-0871

Preferred Name

English

Sofnobrutinib

Official Name

English

1(2H)-Isoquinolinone, 2-[3-[4-amino-6-[(1-methyl-1H-pyrazol-4-yl)amino]-1,3,5-triazin-2-yl]-2-(hydroxymethyl)phenyl]-6-cyclopropyl-8-fluoro-

Systematic Name

English

2-(3-[4-Amino-6-[(1-methyl-1H-pyrazol-4-yl)amino]-1,3,5-triazin-2-yl]-2-(hydroxymethyl)phenyl)-6-cyclopropyl-8-fluoroisoquinolin-1(2H)-one

Systematic Name

English

sofnobrutinib [INN]

Common Name

English

2-[3-{4-amino-6-[(1-methyl-1H-pyrazol-4-yl)amino]- 1,3,5-triazin-2-yl}-2-(hydroxymethyl)phenyl]-6- cyclopropyl-8-fluoroisoquinolin-1(2H)-one

Systematic Name

English

Code System Code Type Description

PUBCHEM

87056204