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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H21ClN4OS
Molecular Weight 412.936
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MK-3168

SMILES

CN(C)C(=O)[C@H]1C[C@@H]1C2=CC=C(C=C2)C3=C(SC4=CC=C(Cl)C=N4)N(C)C=N3

InChI

InChIKey=WRBFPGYDKJBYBI-SJORKVTESA-N
InChI=1S/C21H21ClN4OS/c1-25(2)20(27)17-10-16(17)13-4-6-14(7-5-13)19-21(26(3)12-24-19)28-18-9-8-15(22)11-23-18/h4-9,11-12,16-17H,10H2,1-3H3/t16-,17+/m1/s1

HIDE SMILES / InChI

Molecular Formula C21H21ClN4OS
Molecular Weight 412.936
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 11:59:58 GMT 2023
Edited
by admin
on Sat Dec 16 11:59:58 GMT 2023
Record UNII
CJ67MDQ7KO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MK-3168
Code English
MK3168
Code English
(1S,2S)-2-(4-(5-((5-CHLORO-2-PYRIDINYL)THIO)-1-METHYL-1H-IMIDAZOL-4-YL)PHENYL)-N,N-DIMETHYLCYCLOPROPANECARBOXAMIDE
Systematic Name English
CYCLOPROPANECARBOXAMIDE, 2-(4-(5-((5-CHLORO-2-PYRIDINYL)THIO)-1-METHYL-1H-IMIDAZOL-4-YL)PHENYL)-N,N-DIMETHYL-, (1S,2S)-
Systematic Name English
(1S,2S)-2-(4-(5-((5-CHLOROPYRIDIN-2-YL)THIO)-1-METHYL-1H-IMIDAZOL-4-YL)PHENYL)-N,N-DIMETHYLCYCLOPROPANECARBOXAMIDE
Systematic Name English
MK 3168 [WHO-DD]
Common Name English
Code System Code Type Description
PUBCHEM
46909057
Created by admin on Sat Dec 16 11:59:58 GMT 2023 , Edited by admin on Sat Dec 16 11:59:58 GMT 2023
PRIMARY
CAS
1242441-26-4
Created by admin on Sat Dec 16 11:59:58 GMT 2023 , Edited by admin on Sat Dec 16 11:59:58 GMT 2023
PRIMARY
SMS_ID
300000032820
Created by admin on Sat Dec 16 11:59:58 GMT 2023 , Edited by admin on Sat Dec 16 11:59:58 GMT 2023
PRIMARY
FDA UNII
CJ67MDQ7KO
Created by admin on Sat Dec 16 11:59:58 GMT 2023 , Edited by admin on Sat Dec 16 11:59:58 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
LABELED -> NON-LABELED