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Details

Stereochemistry RACEMIC
Molecular Formula C22H26Cl2N6O5
Molecular Weight 525.385
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0
Stereo Comments Assumed racemic

SHOW SMILES / InChI
Structure of UK-52831

SMILES

CCOC(=O)C1=C(COCCNC2=NC(N)=NN2)NC(C)=C(C1C3=C(Cl)C(Cl)=CC=C3)C(=O)OC

InChI

InChIKey=LECRJMNEIPCUSK-UHFFFAOYSA-N
InChI=1S/C22H26Cl2N6O5/c1-4-35-20(32)17-14(10-34-9-8-26-22-28-21(25)29-30-22)27-11(2)15(19(31)33-3)16(17)12-6-5-7-13(23)18(12)24/h5-7,16,27H,4,8-10H2,1-3H3,(H4,25,26,28,29,30)

HIDE SMILES / InChI

Molecular Formula C22H26Cl2N6O5
Molecular Weight 525.385
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:45:21 GMT 2023
Edited
by admin
on Sat Dec 16 13:45:21 GMT 2023
Record UNII
O4C64ZBB10
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
UK-52831
Code English
3,5-PYRIDINEDICARBOXYLIC ACID, 2-((2-((3-AMINO-1H-1,2,4-TRIAZOL-5-YL)AMINO)ETHOXY)METHYL)-4-(2,3-DICHLOROPHENYL)-1,4-DIHYDRO-6-METHYL-, 3-ETHYL 5-METHYL ESTER
Systematic Name English
Code System Code Type Description
CAS
93118-77-5
Created by admin on Sat Dec 16 13:45:21 GMT 2023 , Edited by admin on Sat Dec 16 13:45:21 GMT 2023
PRIMARY
PUBCHEM
10256296
Created by admin on Sat Dec 16 13:45:21 GMT 2023 , Edited by admin on Sat Dec 16 13:45:21 GMT 2023
PRIMARY
FDA UNII
O4C64ZBB10
Created by admin on Sat Dec 16 13:45:21 GMT 2023 , Edited by admin on Sat Dec 16 13:45:21 GMT 2023
PRIMARY