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Details

Stereochemistry ACHIRAL
Molecular Formula C20H20N8O10S
Molecular Weight 564.485
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 3,8-THIONANEDIONE BIS((2,4-BIS(HYDROXY(OXIDO)AMINO)PHENYL)HYDRAZONE) 1,1-DIOXIDE

SMILES

[O-][N+](=O)C1=CC(=C(N\N=C2/CCCC\C(CS(=O)(=O)C2)=N/NC3=C(C=C(C=C3)[N+]([O-])=O)[N+]([O-])=O)C=C1)[N+]([O-])=O

InChI

InChIKey=KODOIJDVBKKEEB-JFMUQQRKSA-N
InChI=1S/C20H20N8O10S/c29-25(30)15-5-7-17(19(9-15)27(33)34)23-21-13-3-1-2-4-14(12-39(37,38)11-13)22-24-18-8-6-16(26(31)32)10-20(18)28(35)36/h5-10,23-24H,1-4,11-12H2/b21-13+,22-14+

HIDE SMILES / InChI

Molecular Formula C20H20N8O10S
Molecular Weight 564.485
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:05:50 GMT 2023
Edited
by admin
on Sat Dec 16 13:05:50 GMT 2023
Record UNII
6CS49P3XAM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,8-THIONANEDIONE BIS((2,4-BIS(HYDROXY(OXIDO)AMINO)PHENYL)HYDRAZONE) 1,1-DIOXIDE
Common Name English
NSC-359454
Code English
3,8-Thionanedione, 3,8-bis[2-(2,4-dinitrophenyl)hydrazone], 1,1-dioxide
Systematic Name English
Code System Code Type Description
NSC
359454
Created by admin on Sat Dec 16 13:05:50 GMT 2023 , Edited by admin on Sat Dec 16 13:05:50 GMT 2023
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FDA UNII
6CS49P3XAM
Created by admin on Sat Dec 16 13:05:50 GMT 2023 , Edited by admin on Sat Dec 16 13:05:50 GMT 2023
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CAS
71138-49-3
Created by admin on Sat Dec 16 13:05:50 GMT 2023 , Edited by admin on Sat Dec 16 13:05:50 GMT 2023
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PUBCHEM
9569399
Created by admin on Sat Dec 16 13:05:50 GMT 2023 , Edited by admin on Sat Dec 16 13:05:50 GMT 2023
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