U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C28H24ClN3O6
Molecular Weight 533.96
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LY-402913

SMILES

COC1=CC(NC(=O)CC2=CC=CC(=C2)N3C(=O)C4=C(ON=C4C)C5=C3C=CC=C5Cl)=CC(OC)=C1OC

InChI

InChIKey=VHYMJFJCXJXINF-UHFFFAOYSA-N
InChI=1S/C28H24ClN3O6/c1-15-24-27(38-31-15)25-19(29)9-6-10-20(25)32(28(24)34)18-8-5-7-16(11-18)12-23(33)30-17-13-21(35-2)26(37-4)22(14-17)36-3/h5-11,13-14H,12H2,1-4H3,(H,30,33)

HIDE SMILES / InChI

Molecular Formula C28H24ClN3O6
Molecular Weight 533.96
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 08:14:09 GMT 2023
Edited
by admin
on Sat Dec 16 08:14:09 GMT 2023
Record UNII
4XKW2E9G3P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LY-402913
Common Name English
BENZENEACETAMIDE, 3-(9-CHLORO-3-METHYL-4-OXOISOXAZOLO(4,5-C)QUINOLIN-5(4H)-YL)-N-(3,4,5-TRIMETHOXYPHENYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
4XKW2E9G3P
Created by admin on Sat Dec 16 08:14:09 GMT 2023 , Edited by admin on Sat Dec 16 08:14:09 GMT 2023
PRIMARY
CAS
334970-65-9
Created by admin on Sat Dec 16 08:14:09 GMT 2023 , Edited by admin on Sat Dec 16 08:14:09 GMT 2023
PRIMARY
PUBCHEM
59119386
Created by admin on Sat Dec 16 08:14:09 GMT 2023 , Edited by admin on Sat Dec 16 08:14:09 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY