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Details

Stereochemistry ACHIRAL
Molecular Formula C28H25F2N5O5S
Molecular Weight 581.59
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IRC-083864

SMILES

CN(CCCNC1=CC(=O)C2=C(OC(=N2)C3=CC(F)=CC=C3F)C1=O)CCCNC4=CC(=O)C5=C(N=C(C)S5)C4=O

InChI

InChIKey=GAKKGSMRAKEWDN-UHFFFAOYSA-N
InChI=1S/C28H25F2N5O5S/c1-14-33-23-24(38)18(13-21(37)27(23)41-14)31-7-3-9-35(2)10-4-8-32-19-12-20(36)22-26(25(19)39)40-28(34-22)16-11-15(29)5-6-17(16)30/h5-6,11-13,31-32H,3-4,7-10H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C28H25F2N5O5S
Molecular Weight 581.59
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 Mon Mar 31 21:56:18 GMT 2025
Edited
by admin
on Mon Mar 31 21:56:18 GMT 2025
Record UNII
3WT320F1LY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IRC-083864
Common Name English
4,7-BENZOXAZOLEDIONE, 2-(2,5-DIFLUOROPHENYL)-6-((3-((3-((4,7-DIHYDRO-2-METHYL-4,7-DIOXO-5-BENZOTHIAZOLYL)AMINO)PROPYL)METHYLAMINO)PROPYL)AMINO)-
Preferred Name English
Code System Code Type Description
PUBCHEM
24771376
Created by admin on Mon Mar 31 21:56:18 GMT 2025 , Edited by admin on Mon Mar 31 21:56:18 GMT 2025
PRIMARY
CAS
1142057-18-8
Created by admin on Mon Mar 31 21:56:18 GMT 2025 , Edited by admin on Mon Mar 31 21:56:18 GMT 2025
PRIMARY
FDA UNII
3WT320F1LY
Created by admin on Mon Mar 31 21:56:18 GMT 2025 , Edited by admin on Mon Mar 31 21:56:18 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY