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Details

Stereochemistry ACHIRAL
Molecular Formula C26H26N4O3
Molecular Weight 442.5096
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VILAZODONE CARBOXYLIC ACID

SMILES

OC(=O)C1=CC2=C(O1)C=CC(=C2)N3CCN(CCCCC4=CNC5=CC=C(C=C45)C#N)CC3

InChI

InChIKey=RSXUEYFLDNUILS-UHFFFAOYSA-N
InChI=1S/C26H26N4O3/c27-16-18-4-6-23-22(13-18)19(17-28-23)3-1-2-8-29-9-11-30(12-10-29)21-5-7-24-20(14-21)15-25(33-24)26(31)32/h4-7,13-15,17,28H,1-3,8-12H2,(H,31,32)

HIDE SMILES / InChI

Molecular Formula C26H26N4O3
Molecular Weight 442.5096
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 14:47:57 UTC 2023
Edited
by admin
on Sat Dec 16 14:47:57 UTC 2023
Record UNII
93K783WZV4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VILAZODONE CARBOXYLIC ACID
Common Name English
5-(4-(4-(5-CYANO-1H-INDOL-3-YL)BUTYL)-1-PIPERAZINYL)-2-BENZOFURANCARBOXYLIC ACID
Systematic Name English
2-BENZOFURANCARBOXYLIC ACID, 5-(4-(4-(5-CYANO-1H-INDOL-3-YL)BUTYL)-1-PIPERAZINYL)-
Systematic Name English
VILAZODONE METABOLITE M10
Common Name English
Code System Code Type Description
CAS
163521-19-5
Created by admin on Sat Dec 16 14:47:57 UTC 2023 , Edited by admin on Sat Dec 16 14:47:57 UTC 2023
PRIMARY
EPA CompTox
DTXSID70458579
Created by admin on Sat Dec 16 14:47:57 UTC 2023 , Edited by admin on Sat Dec 16 14:47:57 UTC 2023
PRIMARY
PUBCHEM
11201569
Created by admin on Sat Dec 16 14:47:57 UTC 2023 , Edited by admin on Sat Dec 16 14:47:57 UTC 2023
PRIMARY
FDA UNII
93K783WZV4
Created by admin on Sat Dec 16 14:47:57 UTC 2023 , Edited by admin on Sat Dec 16 14:47:57 UTC 2023
PRIMARY
Related Record Type Details
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