Unecritinib

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H24Cl2FN5O2
Molecular Weight	492.373
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H](OC1=CC(=CN=C1NC(C)=O)C2=CN(N=C2)C3CCNCC3)C4=C(Cl)C(F)=CC=C4Cl

InChI

InChIKey=HBWSXXBJOQKNBL-CYBMUJFWSA-N

InChI=1S/C23H24Cl2FN5O2/c1-13(21-18(24)3-4-19(26)22(21)25)33-20-9-15(10-28-23(20)30-14(2)32)16-11-29-31(12-16)17-5-7-27-8-6-17/h3-4,9-13,17,27H,5-8H2,1-2H3,(H,28,30,32)/t13-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C23H24Cl2FN5O2
Molecular Weight	492.373
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:33:38 GMT 2023` Edited by `admin` on `Sat Dec 16 19:33:38 GMT 2023`
Record UNII	4T3Z98RR86
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Unecritinib

Official Name

English

N-{3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1- (piperidin-4-yl)-1H-pyrazol-4-yl]pyridin-2-yl}acetamide

Systematic Name

English

TQB3101

Code

English

unecritinib [INN]

Common Name

English

Acetamide, N-[3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1-(4-piperidinyl)-1H-pyrazol-4-yl]-2-pyridinyl]-

Systematic Name

English

TQ-B3101

Code

English

Code System Code Type Description

PUBCHEM

71506874