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

Details

Stereochemistry ACHIRAL
Molecular Formula C26H23ClN2O5
Molecular Weight 478.924
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DM-4103

SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C(=O)NC3=CC=C(Cl)C=C3C(=O)CCC(O)=O)C(C)=C2

InChI

InChIKey=PRTSBHBGYFDAAS-UHFFFAOYSA-N
InChI=1S/C26H23ClN2O5/c1-15-5-3-4-6-19(15)25(33)28-18-8-9-20(16(2)13-18)26(34)29-22-10-7-17(27)14-21(22)23(30)11-12-24(31)32/h3-10,13-14H,11-12H2,1-2H3,(H,28,33)(H,29,34)(H,31,32)

HIDE SMILES / InChI

Molecular Formula C26H23ClN2O5
Molecular Weight 478.924
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 11:31:00 GMT 2023
Edited
by admin
on Sat Dec 16 11:31:00 GMT 2023
Record UNII
B09E6IIT63
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DM-4103
Code English
5-CHLORO-2-((2-METHYL-4-((2-METHYLBENZOYL)AMINO)BENZOYL)AMINO)-.GAMMA.-OXOBENZENEBUTANOIC ACID
Systematic Name English
TOLVAPTAN METABOLITE DM-4103
Common Name English
BENZENEBUTANOIC ACID, 5-CHLORO-2-((2-METHYL-4-((2-METHYLBENZOYL)AMINO)BENZOYL)AMINO)-.GAMMA.-OXO-
Systematic Name English
Code System Code Type Description
FDA UNII
B09E6IIT63
Created by admin on Sat Dec 16 11:31:00 GMT 2023 , Edited by admin on Sat Dec 16 11:31:00 GMT 2023
PRIMARY
PUBCHEM
71752623
Created by admin on Sat Dec 16 11:31:00 GMT 2023 , Edited by admin on Sat Dec 16 11:31:00 GMT 2023
PRIMARY
CAS
1346599-56-1
Created by admin on Sat Dec 16 11:31:00 GMT 2023 , Edited by admin on Sat Dec 16 11:31:00 GMT 2023
PRIMARY