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Details

Stereochemistry RACEMIC
Molecular Formula C13H18ClN3O8S2
Molecular Weight 443.88
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of KS-119

SMILES

CC(OC(=O)N(N(CCCl)S(C)(=O)=O)S(C)(=O)=O)C1=CC=C(C=C1)[N+]([O-])=O

InChI

InChIKey=DEZODTPLVNXUTD-UHFFFAOYSA-N
InChI=1S/C13H18ClN3O8S2/c1-10(11-4-6-12(7-5-11)17(19)20)25-13(18)16(27(3,23)24)15(9-8-14)26(2,21)22/h4-7,10H,8-9H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C13H18ClN3O8S2
Molecular Weight 443.88
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:37:30 GMT 2025
Edited
by admin
on Mon Mar 31 22:37:30 GMT 2025
Record UNII
P88JL9P99P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HYDRAZINECARBOXYLIC ACID, 2-(2-CHLOROETHYL)-1,2-BIS(METHYLSULFONYL)-, 1-(4-NITROPHENYL)ETHYL ESTER
Preferred Name English
KS-119
Common Name English
1-(4-NITROPHENYL)ETHYL 2-(2-CHLOROETHYL)-1,2-BIS(METHYLSULFONYL)HYDRAZINECARBOXYLATE
Systematic Name English
Code System Code Type Description
FDA UNII
P88JL9P99P
Created by admin on Mon Mar 31 22:37:30 GMT 2025 , Edited by admin on Mon Mar 31 22:37:30 GMT 2025
PRIMARY
CAS
221675-53-2
Created by admin on Mon Mar 31 22:37:30 GMT 2025 , Edited by admin on Mon Mar 31 22:37:30 GMT 2025
PRIMARY
PUBCHEM
9868067
Created by admin on Mon Mar 31 22:37:30 GMT 2025 , Edited by admin on Mon Mar 31 22:37:30 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY