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Details

Stereochemistry ACHIRAL
Molecular Formula C25H21F4N3O3
Molecular Weight 487.4462
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Fulimetibant

SMILES

OC(=O)C1=C(C=CC(NC(=O)C2(CC2)C3=C(F)C=C(C=C3)C(F)(F)F)=C1)C4=CN(N=C4)C5CCC5

InChI

InChIKey=DFQFSWDEFZCQLH-UHFFFAOYSA-N
InChI=1S/C25H21F4N3O3/c26-21-10-15(25(27,28)29)4-7-20(21)24(8-9-24)23(35)31-16-5-6-18(19(11-16)22(33)34)14-12-30-32(13-14)17-2-1-3-17/h4-7,10-13,17H,1-3,8-9H2,(H,31,35)(H,33,34)

HIDE SMILES / InChI

Molecular Formula C25H21F4N3O3
Molecular Weight 487.4462
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 19:20:33 UTC 2023
Edited
by admin
on Sat Dec 16 19:20:33 UTC 2023
Record UNII
Z93D4NV99S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Fulimetibant
INN  
Official Name English
Benzoic acid, 2-(1-cyclobutyl-1H-pyrazol-4-yl)-5-[[[1-[2-fluoro-4-(trifluoromethyl)phenyl]cyclopropyl]carbonyl]amino]-
Systematic Name English
2-(1-cyclobutyl-1H-pyrazol-4-yl)-5-{1-[2-fluoro-4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamido}benzoic acid
Systematic Name English
fulimetibant [INN]
Common Name English
2-(1-Cyclobutyl-1H-pyrazol-4-yl)-5-[([1-[2-fluoro-4-(trifluoromethyl)phenyl]cyclopropyl]carbonyl)amino]benzoic acid
Systematic Name English
Code System Code Type Description
CAS
2231142-90-6
Created by admin on Sat Dec 16 19:20:33 UTC 2023 , Edited by admin on Sat Dec 16 19:20:33 UTC 2023
PRIMARY
SMS_ID
300000041570
Created by admin on Sat Dec 16 19:20:33 UTC 2023 , Edited by admin on Sat Dec 16 19:20:33 UTC 2023
PRIMARY
NCI_THESAURUS
C190503
Created by admin on Sat Dec 16 19:20:33 UTC 2023 , Edited by admin on Sat Dec 16 19:20:33 UTC 2023
PRIMARY
INN
12338
Created by admin on Sat Dec 16 19:20:33 UTC 2023 , Edited by admin on Sat Dec 16 19:20:33 UTC 2023
PRIMARY
PUBCHEM
135150671
Created by admin on Sat Dec 16 19:20:33 UTC 2023 , Edited by admin on Sat Dec 16 19:20:33 UTC 2023
PRIMARY
FDA UNII
Z93D4NV99S
Created by admin on Sat Dec 16 19:20:33 UTC 2023 , Edited by admin on Sat Dec 16 19:20:33 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
PRECLINICAL
Related Record Type Details
ACTIVE MOIETY