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Details

Stereochemistry ACHIRAL
Molecular Formula C32H26N8O10S2.2Na
Molecular Weight 792.706
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of ANTIPYRYLAZO III DISODIUM

SMILES

[Na+].[Na+].CN1N(C(=O)C(\N=N\C2=C(O)C3=C(O)C(\N=N\C4=C(C)N(C)N(C4=O)C5=CC=CC=C5)=C(C=C3C=C2S([O-])(=O)=O)S([O-])(=O)=O)=C1C)C6=CC=CC=C6

InChI

InChIKey=JJNMVMQGDVWCSQ-UUIOKUIJSA-L
InChI=1S/C32H28N8O10S2.2Na/c1-17-25(31(43)39(37(17)3)20-11-7-5-8-12-20)33-35-27-22(51(45,46)47)15-19-16-23(52(48,49)50)28(30(42)24(19)29(27)41)36-34-26-18(2)38(4)40(32(26)44)21-13-9-6-10-14-21;;/h5-16,41-42H,1-4H3,(H,45,46,47)(H,48,49,50);;/q;2*+1/p-2/b35-33+,36-34+;;

HIDE SMILES / InChI

Molecular Formula C32H26N8O10S2
Molecular Weight 746.726
Charge -2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
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 11:13:07 GMT 2023
Edited
by admin
on Sat Dec 16 11:13:07 GMT 2023
Record UNII
UAV9702TGQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ANTIPYRYLAZO III DISODIUM
Common Name English
2,7-NAPHTHALENEDISULFONIC ACID, 3,6-BIS(2-(2,3-DIHYDRO-1,5-DIMETHYL-3-OXO-2-PHENYL-1H-PYRAZOL-4-YL)DIAZENYL)-4,5-DIHYDROXY-, SODIUM SALT (1:2)
Systematic Name English
Code System Code Type Description
CAS
1092119-83-9
Created by admin on Sat Dec 16 11:13:07 GMT 2023 , Edited by admin on Sat Dec 16 11:13:07 GMT 2023
PRIMARY
FDA UNII
UAV9702TGQ
Created by admin on Sat Dec 16 11:13:07 GMT 2023 , Edited by admin on Sat Dec 16 11:13:07 GMT 2023
PRIMARY
PUBCHEM
91864514
Created by admin on Sat Dec 16 11:13:07 GMT 2023 , Edited by admin on Sat Dec 16 11:13:07 GMT 2023
PRIMARY