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Details

Stereochemistry ACHIRAL
Molecular Formula C21H18Cl3N3O3.ClH
Molecular Weight 503.206
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-(3-Chloropropoxy)-4-[(2,4-dichloro-5-methoxyphenyl)amino]-6-methoxy-3-quinolinecarbonitrile hydrochloride

SMILES

Cl.COC1=CC2=C(C=C1OCCCCl)N=CC(C#N)=C2NC3=CC(OC)=C(Cl)C=C3Cl

InChI

InChIKey=VYHMEUCDXRRFLQ-UHFFFAOYSA-N
InChI=1S/C21H18Cl3N3O3.ClH/c1-28-18-9-17(14(23)7-15(18)24)27-21-12(10-25)11-26-16-8-20(30-5-3-4-22)19(29-2)6-13(16)21;/h6-9,11H,3-5H2,1-2H3,(H,26,27);1H

HIDE SMILES / InChI

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

Molecular Formula C21H18Cl3N3O3
Molecular Weight 466.745
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 19:13:21 GMT 2023
Edited
by admin
on Sat Dec 16 19:13:21 GMT 2023
Record UNII
QDM8M22WGZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-(3-Chloropropoxy)-4-[(2,4-dichloro-5-methoxyphenyl)amino]-6-methoxy-3-quinolinecarbonitrile hydrochloride
Systematic Name English
3-Quinolinecarbonitrile, 7-(3-chloropropoxy)-4-[(2,4-dichloro-5-methoxyphenyl)amino]-6-methoxy-, hydrochloride (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
QDM8M22WGZ
Created by admin on Sat Dec 16 19:13:21 GMT 2023 , Edited by admin on Sat Dec 16 19:13:21 GMT 2023
PRIMARY
CAS
2194596-30-8
Created by admin on Sat Dec 16 19:13:21 GMT 2023 , Edited by admin on Sat Dec 16 19:13:21 GMT 2023
PRIMARY
PUBCHEM
130298736
Created by admin on Sat Dec 16 19:13:21 GMT 2023 , Edited by admin on Sat Dec 16 19:13:21 GMT 2023
PRIMARY