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Details

Stereochemistry ACHIRAL
Molecular Formula C18H19ClN2O3
Molecular Weight 346.808
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DM-4130

SMILES

CC1=CC(N)=CC=C1C(=O)NC2=CC=C(Cl)C=C2C(=O)CCCO

InChI

InChIKey=LGBJVEFKIGFPNU-UHFFFAOYSA-N
InChI=1S/C18H19ClN2O3/c1-11-9-13(20)5-6-14(11)18(24)21-16-7-4-12(19)10-15(16)17(23)3-2-8-22/h4-7,9-10,22H,2-3,8,20H2,1H3,(H,21,24)

HIDE SMILES / InChI

Molecular Formula C18H19ClN2O3
Molecular Weight 346.808
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 14:52:55 UTC 2023
Edited
by admin
on Sat Dec 16 14:52:55 UTC 2023
Record UNII
PDW753B41T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DM-4130
Common Name English
BENZAMIDE, 4-AMINO-N-(4-CHLORO-2-(4-HYDROXY-1-OXOBUTYL)PHENYL)-2-METHYL-
Systematic Name English
TOLVAPTAN METABOLITE DM-4130
Common Name English
Code System Code Type Description
PUBCHEM
139593455
Created by admin on Sat Dec 16 14:52:55 UTC 2023 , Edited by admin on Sat Dec 16 14:52:55 UTC 2023
PRIMARY
FDA UNII
PDW753B41T
Created by admin on Sat Dec 16 14:52:55 UTC 2023 , Edited by admin on Sat Dec 16 14:52:55 UTC 2023
PRIMARY
CAS
1809089-49-3
Created by admin on Sat Dec 16 14:52:55 UTC 2023 , Edited by admin on Sat Dec 16 14:52:55 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
FECAL; URINE