4-((4-CHLORO-6-ISOPROPOXY-1,3,5-TRIAZIN-2-YL)AMINO)-2-(2-(1-(2-CHLORO-6-METHYLPHENYL)-3-METHYL-5-OXO-4H-PYRAZOL-4-YL)DIAZEN-1-YL)BENZENESULFONIC ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H22Cl2N8O5S
Molecular Weight	593.4442
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 4-((4-CHLORO-6-ISOPROPOXY-1,3,5-TRIAZIN-2-YL)AMINO)-2-(2-(1-(2-CHLORO-6-METHYLPHENYL)-3-METHYL-5-OXO-4H-PYRAZOL-4-YL)DIAZEN-1-YL)BENZENESULFONIC ACID

Structure Search

SMILES

CC(C)OC1=NC(NC2=CC(\N=N\C3=C(O)N(N=C3C)C4=C(C)C=CC=C4Cl)=C(C=C2)S(O)(=O)=O)=NC(Cl)=N1

InChI

InChIKey=UVGPFXHZRGEKQA-NVQSTNCTSA-N

InChI=1S/C23H22Cl2N8O5S/c1-11(2)38-23-28-21(25)27-22(29-23)26-14-8-9-17(39(35,36)37)16(10-14)30-31-18-13(4)32-33(20(18)34)19-12(3)6-5-7-15(19)24/h5-11,34H,1-4H3,(H,35,36,37)(H,26,27,28,29)/b31-30+

HIDE SMILES / InChI

Molecular Formula	C23H22Cl2N8O5S
Molecular Weight	593.4442
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 20:40:01 GMT 2025` Edited by `admin` on `Tue Apr 01 20:40:01 GMT 2025`
Record UNII	17E95CEZ1Q
Record Status	`FAILED`
Record Version

Download

Name

Type

Language

4-((4-CHLORO-6-(1-METHYLETHOXY)-1,3,5-TRIAZIN-2-YL)AMINO)-2-(2-(1-(2-CHLORO-6-METHYLPHENYL)-4,5-DIHYDRO-3-METHYL-5-OXO-1H-PYRAZOL-4-YL)DIAZENYL)BENZENESULFONIC ACID

Preferred Name

English

4-((4-CHLORO-6-ISOPROPOXY-1,3,5-TRIAZIN-2-YL)AMINO)-2-(2-(1-(2-CHLORO-6-METHYLPHENYL)-3-METHYL-5-OXO-4H-PYRAZOL-4-YL)DIAZEN-1-YL)BENZENESULFONIC ACID

Systematic Name

English

BENZENESULFONIC ACID, 4-((4-CHLORO-6-(1-METHYLETHOXY)-1,3,5-TRIAZIN-2-YL)AMINO)-2-((1-(2-CHLORO-6-METHYLPHENYL)-4,5-DIHYDRO-3-METHYL-5-OXO-1H-PYRAZOL-4-YL)AZO)-

Systematic Name

English

BENZENESULFONIC ACID, 4-((4-CHLORO-6-(1-METHYLETHOXY)-1,3,5-TRIAZIN-2-YL)AMINO)-2-(2-(1-(2-CHLORO-6-METHYLPHENYL)-4,5-DIHYDRO-3-METHYL-5-OXO-1H-PYRAZOL-4-YL)DIAZENYL)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID101099437

Created by admin on Tue Apr 01 20:40:01 GMT 2025 , Edited by admin on Tue Apr 01 20:40:01 GMT 2025

PRIMARY

CAS

93804-38-7

Created by admin on Tue Apr 01 20:40:01 GMT 2025 , Edited by admin on Tue Apr 01 20:40:01 GMT 2025

PRIMARY

ECHA (EC/EINECS)

298-414-1

Created by admin on Tue Apr 01 20:40:01 GMT 2025 , Edited by admin on Tue Apr 01 20:40:01 GMT 2025

PRIMARY

FDA UNII

17E95CEZ1Q

Created by admin on Tue Apr 01 20:40:01 GMT 2025 , Edited by admin on Tue Apr 01 20:40:01 GMT 2025

PRIMARY

Related Record Type Details


					158LQ9WJ3G

SODIUM 4-((4-CHLORO-6-ISOPROPOXY-1,3,5-TRIAZIN-2-YL)AMINO)-2-(2-(1-(2-CHLORO-6-METHYLPHENYL)-3-METHYL-5-OXO-4H-PYRAZOL-4-YL)DIAZEN-1-YL)BENZENESULFONATE

SALT/SOLVATE -> PARENT