5,5'-(Methyl-imino)bis[2-(3,4-dimethoxyphenyl)-2-(1-methylethyl)pentanenitrile] hydrochloride

Details

Stereochemistry	MIXED
Molecular Formula	C33H47N3O4.ClH
Molecular Weight	586.205
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5,5'-(Methyl-imino)bis[2-(3,4-dimethoxyphenyl)-2-(1-methylethyl)pentanenitrile] hydrochloride

Structure Search

SMILES

Cl.COC1=CC=C(C=C1OC)C(CCCN(C)CCCC(C#N)(C(C)C)C2=CC=C(OC)C(OC)=C2)(C#N)C(C)C

InChI

InChIKey=LTHJOWASXURSKK-UHFFFAOYSA-N

InChI=1S/C33H47N3O4.ClH/c1-24(2)32(22-34,26-12-14-28(37-6)30(20-26)39-8)16-10-18-36(5)19-11-17-33(23-35,25(3)4)27-13-15-29(38-7)31(21-27)40-9;/h12-15,20-21,24-25H,10-11,16-19H2,1-9H3;1H

HIDE SMILES / InChI

Molecular Formula	C33H47N3O4
Molecular Weight	549.744
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	ClH
Molecular Weight	36.461
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 19:27:27 GMT 2025` Edited by `admin` on `Wed Apr 02 19:27:27 GMT 2025`
Record UNII	RFN6N4H7GU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-{[4-cyano-4-(3,4-dimethoxyphenyl)-4-(propan-2-yl)butyl](methyl)amino}-2-(3,4-dimethoxyphenyl)-2-(propan-2-yl)pentanenitrile hydrochloride

Preferred Name

English

5,5'-(Methyl-imino)bis[2-(3,4-dimethoxyphenyl)-2-(1-methylethyl)pentanenitrile] hydrochloride

Systematic Name

English

Code System Code Type Description

CAS

2726492-31-3

Created by admin on Wed Apr 02 19:27:27 GMT 2025 , Edited by admin on Wed Apr 02 19:27:27 GMT 2025

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PUBCHEM

129318327

Created by admin on Wed Apr 02 19:27:27 GMT 2025 , Edited by admin on Wed Apr 02 19:27:27 GMT 2025

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FDA UNII

RFN6N4H7GU

Created by admin on Wed Apr 02 19:27:27 GMT 2025 , Edited by admin on Wed Apr 02 19:27:27 GMT 2025

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Related Record Type Details


					ZV16AM38V3

5,5'-(METHYLIMINO)BIS(2-(3,4-DIMETHOXYPHENYL)-2-(1-METHYLETHYL)PENTANENITRILE)

PARENT -> SALT/SOLVATE

Amount: