5-Dehydro Tolvaptan

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H23ClN2O3
Molecular Weight	446.925
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=C(C=CC=C1)C(=O)NC2=CC(C)=C(C=C2)C(=O)N3CCCC(=O)C4=C3C=CC(Cl)=C4

InChI

InChIKey=VENGMROMZOKURN-UHFFFAOYSA-N

InChI=1S/C26H23ClN2O3/c1-16-6-3-4-7-20(16)25(31)28-19-10-11-21(17(2)14-19)26(32)29-13-5-8-24(30)22-15-18(27)9-12-23(22)29/h3-4,6-7,9-12,14-15H,5,8,13H2,1-2H3,(H,28,31)

HIDE SMILES / InChI

Molecular Formula	C26H23ClN2O3
Molecular Weight	446.925
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 `Wed Apr 02 13:24:07 GMT 2025` Edited by `admin` on `Wed Apr 02 13:24:07 GMT 2025`
Record UNII	YR22W5RA83
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

5-Dehydro Tolvaptan

Common Name

English

Benzamide, N-[4-[(7-chloro-2,3,4,5-tetrahydro-5-oxo-1H-1-benzazepin-1-yl)carbonyl]-3-methylphenyl]-2-methyl-

Preferred Name

English

N-[4-[(7-Chloro-2,3,4,5-tetrahydro-5-oxo-1H-1-benzazepin-1-yl)carbonyl]-3-methylphenyl]-2-methylbenzamide

Systematic Name

English

Code System Code Type Description

CAS

137973-76-3

Created by admin on Wed Apr 02 13:24:07 GMT 2025 , Edited by admin on Wed Apr 02 13:24:07 GMT 2025

PRIMARY

FDA UNII

YR22W5RA83

Created by admin on Wed Apr 02 13:24:07 GMT 2025 , Edited by admin on Wed Apr 02 13:24:07 GMT 2025

PRIMARY

EPA CompTox

DTXSID60463591

Created by admin on Wed Apr 02 13:24:07 GMT 2025 , Edited by admin on Wed Apr 02 13:24:07 GMT 2025

PRIMARY

PUBCHEM

11362843

Created by admin on Wed Apr 02 13:24:07 GMT 2025 , Edited by admin on Wed Apr 02 13:24:07 GMT 2025

PRIMARY