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Details

Stereochemistry ACHIRAL
Molecular Formula C28H26ClN3O
Molecular Weight 455.979
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 1-(3-chlorophenyl)-3-ethyl-9-methoxy-5-(2-phenylethenyl)-1H,2H,3H,4H-pyrimido[5,4-c]quinoline

SMILES

CCN1CN(C2=CC(Cl)=CC=C2)C3=C4C=C(OC)C=CC4=NC(\C=C\C5=CC=CC=C5)=C3C1

InChI

InChIKey=JQJPIQDBZBRUTN-WYMLVPIESA-N
InChI=1S/C28H26ClN3O/c1-3-31-18-25-27(14-12-20-8-5-4-6-9-20)30-26-15-13-23(33-2)17-24(26)28(25)32(19-31)22-11-7-10-21(29)16-22/h4-17H,3,18-19H2,1-2H3/b14-12+

HIDE SMILES / InChI

Molecular Formula C28H26ClN3O
Molecular Weight 455.979
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:31:23 GMT 2023
Edited
by admin
on Sat Dec 16 18:31:23 GMT 2023
Record UNII
8MD3L9JKX4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(3-chlorophenyl)-3-ethyl-9-methoxy-5-(2-phenylethenyl)-1H,2H,3H,4H-pyrimido[5,4-c]quinoline
Systematic Name English
1-(3-CHLOROPHENYL)-3-ETHYL-5-(2-PHENYLVINYL)-1,2,3,4-TETRAHYDROPYRIMIDO(5,4-C)QUINOLIN-9-YL METHYL ETHER
Systematic Name English
Pyrimido[5,4-c]quinoline, 1-(3-chlorophenyl)-3-ethyl-1,2,3,4-tetrahydro-9-methoxy-5-(2-phenylethenyl)-
Systematic Name English
NSC-340852
Code English
Code System Code Type Description
FDA UNII
8MD3L9JKX4
Created by admin on Sat Dec 16 18:31:23 GMT 2023 , Edited by admin on Sat Dec 16 18:31:23 GMT 2023
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PUBCHEM
5917777
Created by admin on Sat Dec 16 18:31:23 GMT 2023 , Edited by admin on Sat Dec 16 18:31:23 GMT 2023
PRIMARY
NSC
340852
Created by admin on Sat Dec 16 18:31:23 GMT 2023 , Edited by admin on Sat Dec 16 18:31:23 GMT 2023
PRIMARY
CAS
65273-94-1
Created by admin on Sat Dec 16 18:31:23 GMT 2023 , Edited by admin on Sat Dec 16 18:31:23 GMT 2023
PRIMARY