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Details

Stereochemistry ACHIRAL
Molecular Formula C24H26N4O3.2ClH
Molecular Weight 491.41
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NRC-2694 DIHYDROCHLORIDE

SMILES

Cl.Cl.COC1=CC2=NC=NC(NC3=CC=CC(=C3)C#C)=C2C=C1OCCCN4CCOCC4

InChI

InChIKey=HHXJUNYMDONXMO-UHFFFAOYSA-N
InChI=1S/C24H26N4O3.2ClH/c1-3-18-6-4-7-19(14-18)27-24-20-15-23(22(29-2)16-21(20)25-17-26-24)31-11-5-8-28-9-12-30-13-10-28;;/h1,4,6-7,14-17H,5,8-13H2,2H3,(H,25,26,27);2*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 C24H26N4O3
Molecular Weight 418.4882
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 18:53:37 GMT 2023
Edited
by admin
on Sat Dec 16 18:53:37 GMT 2023
Record UNII
JRT6MBD7C2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NRC-2694 DIHYDROCHLORIDE
Code English
N-(3-ETHYNYLPHENYL)-7-METHOXY-6-(3-(4-MORPHOLINYL)PROPOXY)-4-QUINAZOLINAMINE DIHYDROCHLORIDE
Systematic Name English
NRC-2694B
Code English
4-QUINAZOLINAMINE, N-(3-ETHYNYLPHENYL)-7-METHOXY-6-(3-(4-MORPHOLINYL)PROPOXY)-, HYDROCHLORIDE (1:2)
Systematic Name English
Code System Code Type Description
NCI_THESAURUS
C187044
Created by admin on Sat Dec 16 18:53:37 GMT 2023 , Edited by admin on Sat Dec 16 18:53:37 GMT 2023
PRIMARY
FDA UNII
JRT6MBD7C2
Created by admin on Sat Dec 16 18:53:37 GMT 2023 , Edited by admin on Sat Dec 16 18:53:37 GMT 2023
PRIMARY
CAS
936362-49-1
Created by admin on Sat Dec 16 18:53:37 GMT 2023 , Edited by admin on Sat Dec 16 18:53:37 GMT 2023
NON-SPECIFIC STOICHIOMETRY
CAS
1172627-00-7
Created by admin on Sat Dec 16 18:53:37 GMT 2023 , Edited by admin on Sat Dec 16 18:53:37 GMT 2023
PRIMARY
PUBCHEM
44194962
Created by admin on Sat Dec 16 18:53:37 GMT 2023 , Edited by admin on Sat Dec 16 18:53:37 GMT 2023
PRIMARY
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ACTIVE MOIETY