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Details

Stereochemistry ACHIRAL
Molecular Formula C20H22ClN7O3
Molecular Weight 443.887
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-[2-[4-[[4-[Bis(2-hydroxyethyl)amino]-6-chloro-1,3,5-triazin-2-yl]amino]phenyl]diazenyl]-4-methylphenol

SMILES

CC1=CC=C(O)C(=C1)N=NC2=CC=C(NC3=NC(Cl)=NC(=N3)N(CCO)CCO)C=C2

InChI

InChIKey=XIUWOZNEOQZJBS-UHFFFAOYSA-N
InChI=1S/C20H22ClN7O3/c1-13-2-7-17(31)16(12-13)27-26-15-5-3-14(4-6-15)22-19-23-18(21)24-20(25-19)28(8-10-29)9-11-30/h2-7,12,29-31H,8-11H2,1H3,(H,22,23,24,25)

HIDE SMILES / InChI

Molecular Formula C20H22ClN7O3
Molecular Weight 443.887
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 Tue Apr 01 17:44:52 GMT 2025
Edited
by admin
on Tue Apr 01 17:44:52 GMT 2025
Record UNII
6M7M6QLK8U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-[2-[4-[[4-[Bis(2-hydroxyethyl)amino]-6-chloro-1,3,5-triazin-2-yl]amino]phenyl]diazenyl]-4-methylphenol
Systematic Name English
Phenol, 2-[[4-[[4-[bis(2-hydroxyethyl)amino]-6-chloro-1,3,5-triazin-2-yl]amino]phenyl]azo]-4-methyl-
Preferred Name English
Phenol, 2-[2-[4-[[4-[bis(2-hydroxyethyl)amino]-6-chloro-1,3,5-triazin-2-yl]amino]phenyl]diazenyl]-4-methyl-
Systematic Name English
Code System Code Type Description
PUBCHEM
91784
Created by admin on Tue Apr 01 17:44:52 GMT 2025 , Edited by admin on Tue Apr 01 17:44:52 GMT 2025
PRIMARY
ECHA (EC/EINECS)
260-088-3
Created by admin on Tue Apr 01 17:44:52 GMT 2025 , Edited by admin on Tue Apr 01 17:44:52 GMT 2025
PRIMARY
FDA UNII
6M7M6QLK8U
Created by admin on Tue Apr 01 17:44:52 GMT 2025 , Edited by admin on Tue Apr 01 17:44:52 GMT 2025
PRIMARY
EPA CompTox
DTXSID5069091
Created by admin on Tue Apr 01 17:44:52 GMT 2025 , Edited by admin on Tue Apr 01 17:44:52 GMT 2025
PRIMARY
CAS
56275-25-3
Created by admin on Tue Apr 01 17:44:52 GMT 2025 , Edited by admin on Tue Apr 01 17:44:52 GMT 2025
PRIMARY