2-[[4-[[(2-Chlorobenzyl)]ethylamino]-O-tolyl]azo]benzothiazole-6-sulfonic acid

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H21ClN4O3S2
Molecular Weight	501.021
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 2-[[4-[[(2-Chlorobenzyl)]ethylamino]-O-tolyl]azo]benzothiazole-6-sulfonic acid

Structure Search

SMILES

CCN(CC1=CC=CC=C1Cl)C2=CC=C(N=NC3=NC4=CC=C(C=C4S3)S(O)(=O)=O)C(C)=C2

InChI

InChIKey=RAEKJFJPNAEJQQ-CYYJNZCTSA-N

InChI=1S/C23H21ClN4O3S2/c1-3-28(14-16-6-4-5-7-19(16)24)17-8-10-20(15(2)12-17)26-27-23-25-21-11-9-18(33(29,30)31)13-22(21)32-23/h4-13H,3,14H2,1-2H3,(H,29,30,31)/b27-26+

HIDE SMILES / InChI

Molecular Formula	C23H21ClN4O3S2
Molecular Weight	501.021
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 17:48:20 GMT 2025` Edited by `admin` on `Tue Apr 01 17:48:20 GMT 2025`
Record UNII	X48D4CXL5P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6-BENZOTHIAZOLESULFONIC ACID, 2-((4-(((2-CHLOROPHENYL)METHYL)ETHYLAMINO)-2-METHYLPHENYL)AZO)-

Preferred Name

English

2-[[4-[[(2-Chlorobenzyl)]ethylamino]-O-tolyl]azo]benzothiazole-6-sulfonic acid

Systematic Name

English

2-[2-[4-[[(2-Chlorophenyl)methyl]ethylamino]-2-methylphenyl]diazenyl]-6-benzothiazolesulfonic acid

Systematic Name

English

6-Benzothiazolesulfonic acid, 2-[2-[4-[[(2-chlorophenyl)methyl]ethylamino]-2-methylphenyl]diazenyl]-

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

265-371-5