MK-5108

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H21ClFN3O3S
Molecular Weight	461.937
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)[C@@]3(CC1=NC(NC2=NC=CS2)=CC=C1)CC[C@@H](CC3)OC4=CC=CC(Cl)=C4F

InChI

InChIKey=LCVIRAZGMYMNNT-VVONHTQRSA-N

InChI=1S/C22H21ClFN3O3S/c23-16-4-2-5-17(19(16)24)30-15-7-9-22(10-8-15,20(28)29)13-14-3-1-6-18(26-14)27-21-25-11-12-31-21/h1-6,11-12,15H,7-10,13H2,(H,28,29)(H,25,26,27)/t15-,22-

HIDE SMILES / InChI

Molecular Formula	C22H21ClFN3O3S
Molecular Weight	461.937
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:32:11 UTC 2023` Edited by `admin` on `Sat Dec 16 19:32:11 UTC 2023`
Record UNII	H8J407531S
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

MK-5108

Common Name

English

MK 5108

Code

English

VX-689

Code

English

CYCLOHEXANECARBOXYLIC ACID, 4-(3-CHLORO-2-FLUOROPHENOXY)-1-((6-(2-THIAZOLYLAMINO)-2-PYRIDINYL)METHYL)-, TRANS-

Common Name

English

MK5108

Code

English

Code System Code Type Description

EPA CompTox

DTXSID901026054