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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H17F2N3O3
Molecular Weight 361.3427
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BMS-986235

SMILES

COC1=CC(F)=C([C@@H]2CNC(=O)[C@H]2NC(=O)NC3=CC=CC=C3)C(F)=C1

InChI

InChIKey=FJZNNKJZHQFMCK-LRDDRELGSA-N
InChI=1S/C18H17F2N3O3/c1-26-11-7-13(19)15(14(20)8-11)12-9-21-17(24)16(12)23-18(25)22-10-5-3-2-4-6-10/h2-8,12,16H,9H2,1H3,(H,21,24)(H2,22,23,25)/t12-,16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H17F2N3O3
Molecular Weight 361.3427
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 13:32:00 GMT 2023
Edited
by admin
on Sat Dec 16 13:32:00 GMT 2023
Record UNII
F8S5G34WY1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BMS-986235
Code English
LAR-1219
Code English
1-((3S,4R)-4-(2,6-DIFLUORO-4-METHOXYPHENYL)-2-OXOPYRROLIDIN-3-YL)-3-PHENYLUREA
Systematic Name English
Code System Code Type Description
PUBCHEM
122583088
Created by admin on Sat Dec 16 13:32:01 GMT 2023 , Edited by admin on Sat Dec 16 13:32:01 GMT 2023
PRIMARY
CAS
2253947-47-4
Created by admin on Sat Dec 16 13:32:01 GMT 2023 , Edited by admin on Sat Dec 16 13:32:01 GMT 2023
PRIMARY
FDA UNII
F8S5G34WY1
Created by admin on Sat Dec 16 13:32:01 GMT 2023 , Edited by admin on Sat Dec 16 13:32:01 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
AGONIST
EC50
OFF--TARGET->NON-AGONIST
EC50
Related Record Type Details
ACTIVE MOIETY