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Details

Stereochemistry ACHIRAL
Molecular Formula C25H19ClF2N4O4
Molecular Weight 512.893
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BMS-777607

SMILES

CCOC1=C(C(=O)NC2=CC=C(OC3=C(Cl)C(N)=NC=C3)C(F)=C2)C(=O)N(C=C1)C4=CC=C(F)C=C4

InChI

InChIKey=VNBRGSXVFBYQNN-UHFFFAOYSA-N
InChI=1S/C25H19ClF2N4O4/c1-2-35-19-10-12-32(16-6-3-14(27)4-7-16)25(34)21(19)24(33)31-15-5-8-18(17(28)13-15)36-20-9-11-30-23(29)22(20)26/h3-13H,2H2,1H3,(H2,29,30)(H,31,33)

HIDE SMILES / InChI

Molecular Formula C25H19ClF2N4O4
Molecular Weight 512.893
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 04:40:30 UTC 2023
Edited
by admin
on Sat Dec 16 04:40:30 UTC 2023
Record UNII
A3MMS6HDO1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BMS-777607
Code English
ASLAN-002
Code English
3-PYRIDINECARBOXAMIDE, N-(4-((2-AMINO-3-CHLORO-4-PYRIDINYL)OXY)-3-FLUOROPHENYL)-4-ETHOXY-1-(4-FLUOROPHENYL)-1,2-DIHYDRO-2-OXO-
Systematic Name English
ASLAN002
Code English
N-(4-((2-AMINO-3-CHLOROPYRIDIN-4-YL)OXY)-3-FLUOROPHENYL)-4-ETHOXY-1-(4-FLUOROPHENYL)-2-OXO-1,2-DIHYDROPYRIDINE-3-CARBOXAMIDE
Systematic Name English
Code System Code Type Description
CAS
1025720-94-8
Created by admin on Sat Dec 16 04:40:30 UTC 2023 , Edited by admin on Sat Dec 16 04:40:30 UTC 2023
PRIMARY
FDA UNII
A3MMS6HDO1
Created by admin on Sat Dec 16 04:40:30 UTC 2023 , Edited by admin on Sat Dec 16 04:40:30 UTC 2023
PRIMARY
DRUG BANK
DB12064
Created by admin on Sat Dec 16 04:40:30 UTC 2023 , Edited by admin on Sat Dec 16 04:40:30 UTC 2023
PRIMARY
EPA CompTox
DTXSID50145278
Created by admin on Sat Dec 16 04:40:30 UTC 2023 , Edited by admin on Sat Dec 16 04:40:30 UTC 2023
PRIMARY
NCI_THESAURUS
C74060
Created by admin on Sat Dec 16 04:40:30 UTC 2023 , Edited by admin on Sat Dec 16 04:40:30 UTC 2023
PRIMARY
ChEMBL
CHEMBL460702
Created by admin on Sat Dec 16 04:40:30 UTC 2023 , Edited by admin on Sat Dec 16 04:40:30 UTC 2023
PRIMARY
PUBCHEM
24794418
Created by admin on Sat Dec 16 04:40:30 UTC 2023 , Edited by admin on Sat Dec 16 04:40:30 UTC 2023
PRIMARY
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