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Details

Stereochemistry ACHIRAL
Molecular Formula C22H20ClN5O2
Molecular Weight 421.88
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-{[4-chloro-6-(diethylamino)-1,3,5-triazin-2-yl]amino}-3-phenyl-2H-chromen-2-one

SMILES

CCN(CC)C1=NC(Cl)=NC(NC2=CC3=C(C=C2)C=C(C(=O)O3)C4=CC=CC=C4)=N1

InChI

InChIKey=RWZSFMOHCSPTDM-UHFFFAOYSA-N
InChI=1S/C22H20ClN5O2/c1-3-28(4-2)22-26-20(23)25-21(27-22)24-16-11-10-15-12-17(14-8-6-5-7-9-14)19(29)30-18(15)13-16/h5-13H,3-4H2,1-2H3,(H,24,25,26,27)

HIDE SMILES / InChI

Molecular Formula C22H20ClN5O2
Molecular Weight 421.88
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 Fri Dec 15 16:03:45 GMT 2023
Edited
by admin
on Fri Dec 15 16:03:45 GMT 2023
Record UNII
X89V4CV52R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-{[4-chloro-6-(diethylamino)-1,3,5-triazin-2-yl]amino}-3-phenyl-2H-chromen-2-one
Systematic Name English
COUMARIN, 7-((4-CHLORO-6-(DIETHYLAMINO)-S-TRIAZIN-2-YL)AMINO)-3-PHENYL-
Systematic Name English
TINOPAL SFG
Common Name English
NSC-338963
Code English
7-((4-CHLORO-6-(DIETHYLAMINO)-S-TRIAZIN-2-YL)AMINO)-3-PHENYLCOUM
Common Name English
3-PHENYL-7-(4'-CHLORO-6'-DIETHYLAMINO-S-TRIAZINYL-2'-AMINO)COUMARIN
Systematic Name English
7-(2-CHLORO-6-DIETHYLAMINO-S-TRIAZIN-4-YLAMINO)-3-PHENYLCOUMARIN
Systematic Name English
2H-1-BENZOPYRAN-2-ONE, 7-((4-CHLORO-6-(DIETHYLAMINO)-1,3,5-TRIAZIN-2-YL)AMINO)-3-PHENYL-
Systematic Name English
HAKKOL PYB-D
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
226-861-4
Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023
PRIMARY
EPA CompTox
DTXSID5063940
Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023
PRIMARY
PUBCHEM
79650
Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023
PRIMARY
CAS
5516-22-3
Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023
PRIMARY
FDA UNII
X89V4CV52R
Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023
PRIMARY
NSC
338963
Created by admin on Fri Dec 15 16:03:45 GMT 2023 , Edited by admin on Fri Dec 15 16:03:45 GMT 2023
PRIMARY