LY-2940094

Investigational

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H23ClF2N4O2S
Molecular Weight	480.958
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=NN(C=C1CN2CCC3(CC2)OCC(F)(F)C4=C3SC(Cl)=C4)C5=NC=CC=C5CO

InChI

InChIKey=NKQHBJNRBKHUQR-UHFFFAOYSA-N

InChI=1S/C22H23ClF2N4O2S/c1-14-16(11-29(27-14)20-15(12-30)3-2-6-26-20)10-28-7-4-21(5-8-28)19-17(9-18(23)32-19)22(24,25)13-31-21/h2-3,6,9,11,30H,4-5,7-8,10,12-13H2,1H3

HIDE SMILES / InChI

Molecular Formula	C22H23ClF2N4O2S
Molecular Weight	480.958
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 10:55:25 GMT 2023` Edited by `admin` on `Sat Dec 16 10:55:25 GMT 2023`
Record UNII	4I67US2V8Q
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

LY-2940094

Common Name

English

J3.309.394B

Code

English

2-(3-METHYL-4-((2-CHLORO-4,4-DIFLUOROSPIRO(5H-THIENO(2,3-C)PYRAN-7,4'-PIPERIDINE)-1'-YL)METHYL)-1H-PYRAZOLE-1-YL)PYRIDINE-3-METHANOL

Systematic Name

English

(2-(4-((2-CHLORO-4,4-DIFLUORO-SPIRO(5H-THIENO(2,3-C)PYRAN-7,4'-PIPERIDINE)-1'-YL)METHYL)-3-METHYL-PYRAZOL-1-YL)-3-PYRIDYL)METHANOL

Systematic Name

English

BTRX-246040

Code

English

Code System Code Type Description

EPA CompTox

DTXSID201336137