1-AMINO-4-((3-(((3,6-DICHLORO-4-PYRIDAZINYL)CARBONYL)AMINO)-2,4,6-TRIMETHYL-5-SULFOPHENYL)AMINO)-9,10-DIHYDRO-9,10-DIOXO-2-ANTHRACENESULFONIC ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H21Cl2N5O9S2
Molecular Weight	706.53
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-AMINO-4-((3-(((3,6-DICHLORO-4-PYRIDAZINYL)CARBONYL)AMINO)-2,4,6-TRIMETHYL-5-SULFOPHENYL)AMINO)-9,10-DIHYDRO-9,10-DIOXO-2-ANTHRACENESULFONIC ACID

Structure Search

SMILES

CC1=C(NC2=CC(=C(N)C3=C2C(=O)C4=CC=CC=C4C3=O)S(O)(=O)=O)C(C)=C(C(C)=C1NC(=O)C5=C(Cl)N=NC(Cl)=C5)S(O)(=O)=O

InChI

InChIKey=WPNCZPHIKSFVSG-UHFFFAOYSA-N

InChI=1S/C28H21Cl2N5O9S2/c1-10-22(11(2)26(46(42,43)44)12(3)23(10)33-28(38)15-8-18(29)34-35-27(15)30)32-16-9-17(45(39,40)41)21(31)20-19(16)24(36)13-6-4-5-7-14(13)25(20)37/h4-9,32H,31H2,1-3H3,(H,33,38)(H,39,40,41)(H,42,43,44)

HIDE SMILES / InChI

Molecular Formula	C28H21Cl2N5O9S2
Molecular Weight	706.53
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 13:10:52 GMT 2023` Edited by `admin` on `Sat Dec 16 13:10:52 GMT 2023`
Record UNII	96BB4C3CHD
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-AMINO-4-((3-(((3,6-DICHLORO-4-PYRIDAZINYL)CARBONYL)AMINO)-2,4,6-TRIMETHYL-5-SULFOPHENYL)AMINO)-9,10-DIHYDRO-9,10-DIOXO-2-ANTHRACENESULFONIC ACID

Systematic Name

English

2-ANTHRACENESULFONIC ACID, 1-AMINO-4-((3-(((3,6-DICHLORO-4-PYRIDAZINYL)CARBONYL)AMINO)-2,4,6-TRIMETHYL-5-SULFOPHENYL)AMINO)-9,10-DIHYDRO-9,10-DIOXO-

Systematic Name

English

1-AMINO-4-(3-((3,6-DICHLOROPYRIDAZINE-4-CARBONYL)AMINO)-2,4,6-TRIMETHYL-5-SULFOANILINO)-9,10-DIOXOANTHRACENE-2-SULFONIC ACID

Systematic Name

English

1-AMINO-4-(3-(((3,6-DICHLOROPYRIDAZIN-4-YL)CARBONYL)AMINO)-2,4,6-TRIMETHYL-5-SULFOANILINO)-9,10-DIHYDRO-9,10-DIOXOANTHRACENE-2-SULFONIC ACID

Systematic Name

English

1-AMINO-4-(3-(((3,6-DICHLOROPYRIDAZIN-4-YL)CARBONYL)AMINO)-2,4,6-TRIMETHYL-5-SULPHOANILINO)-9,10-DIHYDRO-9,10-DIOXOANTHRACENE-2-SULPHONIC ACID

Systematic Name

English

Code System Code Type Description

PUBCHEM

105803