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Details

Stereochemistry RACEMIC
Molecular Formula C21H23NO4S
Molecular Weight 385.477
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BL-2401

SMILES

CCC(=O)SCC(CC1=CC=CC=C1)C(=O)NC2=CC(C)=CC(=C2)C(O)=O

InChI

InChIKey=VXXKXVZZQWCQQG-UHFFFAOYSA-N
InChI=1S/C21H23NO4S/c1-3-19(23)27-13-17(11-15-7-5-4-6-8-15)20(24)22-18-10-14(2)9-16(12-18)21(25)26/h4-10,12,17H,3,11,13H2,1-2H3,(H,22,24)(H,25,26)

HIDE SMILES / InChI

Molecular Formula C21H23NO4S
Molecular Weight 385.477
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 Mon Mar 31 21:47:26 GMT 2025
Edited
by admin
on Mon Mar 31 21:47:26 GMT 2025
Record UNII
0S7F723B89
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BL-2401
Common Name English
BENZOIC ACID, 3-METHYL-5-((1-OXO-2-(((1-OXOPROPYL)THIO)METHYL)-3-PHENYLPROPYL)AMINO)-
Preferred Name English
BENZOIC ACID, 3-METHYL-5-((1-OXO-2-(((1-OXOPROPYL)THIO)METHYL)-3-PHENYLPROPYL)AMINO)-, (±)-
Systematic Name English
Code System Code Type Description
FDA UNII
0S7F723B89
Created by admin on Mon Mar 31 21:47:26 GMT 2025 , Edited by admin on Mon Mar 31 21:47:26 GMT 2025
PRIMARY
CAS
151774-56-0
Created by admin on Mon Mar 31 21:47:26 GMT 2025 , Edited by admin on Mon Mar 31 21:47:26 GMT 2025
PRIMARY
PUBCHEM
9952090
Created by admin on Mon Mar 31 21:47:26 GMT 2025 , Edited by admin on Mon Mar 31 21:47:26 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY