ILACIRNON

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H13ClF3N5O3S
Molecular Weight	495.862
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=CC(NS(=O)(=O)C2=CC=C(Cl)C(=C2)C(F)(F)F)=C(N=C1)C(=O)C3=C4C=CNC4=NC=N3

InChI

InChIKey=LUUMLYXKTPBTQR-UHFFFAOYSA-N

InChI=1S/C20H13ClF3N5O3S/c1-10-6-15(29-33(31,32)11-2-3-14(21)13(7-11)20(22,23)24)17(26-8-10)18(30)16-12-4-5-25-19(12)28-9-27-16/h2-9,29H,1H3,(H,25,27,28)

HIDE SMILES / InChI

Molecular Formula	C20H13ClF3N5O3S
Molecular Weight	495.862
Charge	0
Count

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

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
C-C chemokine receptor type 2 17 Target ID: CHEMBL4015 Sources: https://www.ncbi.nlm.nih.gov/pubmed/23986513	Antagonist 2778		2.3 nM [Kd]

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:10:49 GMT 2023` Edited by `admin` on `Sat Dec 16 08:10:49 GMT 2023`
Record UNII	380F68J5PH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ILACIRNON

Official Name

English

CCX140

Code

English

ilacirnon [INN]

Common Name

English

4-CHLORO-N-(5-METHYL-2-(7H-PYRROLO(2,3-D)PYRIMIDIN-4-YLCARBONYL)-3-PYRIDINYL)-3-(TRIFLUOROMETHYL)BENZENESULFONAMIDE

Systematic Name

English

BENZENESULFONAMIDE, 4-CHLORO-N-(5-METHYL-2-(7H-PYRROLO(2,3-D)PYRIMIDIN-4-YLCARBONYL)-3-PYRIDINYL)-3-(TRIFLUOROMETHYL)-

Systematic Name

English

ILACIRNON [USAN]

Common Name

English

CCX-140

Code

English

Code System Code Type Description

EVMPD

SUB197614