6,13-DICHLORO-3,10-BIS((4-((4,6-DICHLORO-1,3,5-TRIAZIN-2-YL)AMINO)-3-SULFOPHENYL)AMINO)-4,11-TRIPHENODIOXAZINEDISULFONIC ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C36H18Cl6N12O14S4
Molecular Weight	1183.578
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 6,13-DICHLORO-3,10-BIS((4-((4,6-DICHLORO-1,3,5-TRIAZIN-2-YL)AMINO)-3-SULFOPHENYL)AMINO)-4,11-TRIPHENODIOXAZINEDISULFONIC ACID

Structure Search

SMILES

OS(=O)(=O)C1=C(NC2=NC(Cl)=NC(Cl)=N2)C=CC(NC3=CC=C4N=C5C(Cl)=C6OC7=C(C=CC(NC8=CC(=C(NC9=NC(Cl)=NC(Cl)=N9)C=C8)S(O)(=O)=O)=C7S(O)(=O)=O)N=C6C(Cl)=C5OC4=C3S(O)(=O)=O)=C1

InChI

InChIKey=KKAYGDDJQIVWTE-UHFFFAOYSA-N

InChI=1S/C36H18Cl6N12O14S4/c37-21-24-28(68-26-16(46-24)6-8-18(30(26)72(64,65)66)44-12-2-4-14(20(10-12)70(58,59)60)48-36-53-33(41)50-34(42)54-36)22(38)23-27(21)67-25-15(45-23)5-7-17(29(25)71(61,62)63)43-11-1-3-13(19(9-11)69(55,56)57)47-35-51-31(39)49-32(40)52-35/h1-10,43-44H,(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66)(H,47,49,51,52)(H,48,50,53,54)

HIDE SMILES / InChI

Molecular Formula	C36H18Cl6N12O14S4
Molecular Weight	1183.578
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 16:28:05 GMT 2025` Edited by `admin` on `Tue Apr 01 16:28:05 GMT 2025`
Record UNII	KYO7E9RH08
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

6,13-DICHLORO-3,10-BIS((4-((4,6-DICHLORO-1,3,5-TRIAZIN-2-YL)AMINO)-3-SULFOPHENYL)AMINO)-4,11-TRIPHENODIOXAZINEDISULFONIC ACID

Common Name

English

4,11-TRIPHENODIOXAZINEDISULFONIC ACID, 6,13-DICHLORO-3,10-BIS((4-((4,6-DICHLORO-1,3,5-TRIAZIN-2-YL)AMINO)-3-SULFOPHENYL)AMINO)-

Preferred Name

English

Code System Code Type Description

CAS

42783-03-9

Created by admin on Tue Apr 01 16:28:05 GMT 2025 , Edited by admin on Tue Apr 01 16:28:05 GMT 2025

PRIMARY

FDA UNII

KYO7E9RH08

Created by admin on Tue Apr 01 16:28:05 GMT 2025 , Edited by admin on Tue Apr 01 16:28:05 GMT 2025

PRIMARY

PUBCHEM

88891625

Created by admin on Tue Apr 01 16:28:05 GMT 2025 , Edited by admin on Tue Apr 01 16:28:05 GMT 2025

PRIMARY

Related Record Type Details


					3A5G3JY2K4

TETRASODIUM 6,13-DICHLORO-3,10-BIS((4-((4,6-DICHLORO-1,3,5-TRIAZIN-2-YL)AMINO)-3-SULFOPHENYL)AMINO)-4,11-TRIPHENODIOXAZINEDISULFONATE

SALT/SOLVATE -> PARENT