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Details

Stereochemistry ACHIRAL
Molecular Formula C12H17N2O6PS
Molecular Weight 348.312
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Dimethyl ((3-((2-methyl-1-oxoallyl)amino)phenyl)sulfonyl)phosphoramidate

SMILES

COP(=O)(NS(=O)(=O)C1=CC=CC(NC(=O)C(C)=C)=C1)OC

InChI

InChIKey=VGQJNYUIUBRKHQ-UHFFFAOYSA-N
InChI=1S/C12H17N2O6PS/c1-9(2)12(15)13-10-6-5-7-11(8-10)22(17,18)14-21(16,19-3)20-4/h5-8H,1H2,2-4H3,(H,13,15)(H,14,16)

HIDE SMILES / InChI

Molecular Formula C12H17N2O6PS
Molecular Weight 348.312
Charge 0
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 12:19:09 GMT 2023
Edited
by admin
on Sat Dec 16 12:19:09 GMT 2023
Record UNII
5XJ7KH2PEY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Dimethyl ((3-((2-methyl-1-oxoallyl)amino)phenyl)sulfonyl)phosphoramidate
Systematic Name English
Phosphoramidic acid, [[3-[(2-methyl-1-oxo-2-propenyl)amino]phenyl]sulfonyl]-, dimethyl ester
Systematic Name English
Dimethyl ((3-((2-methyl-1-oxoallyl)amino)phenyl)sulphonyl)phosphoramidate
Systematic Name English
Code System Code Type Description
CAS
15762-53-5
Created by admin on Sat Dec 16 12:19:09 GMT 2023 , Edited by admin on Sat Dec 16 12:19:09 GMT 2023
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FDA UNII
5XJ7KH2PEY
Created by admin on Sat Dec 16 12:19:09 GMT 2023 , Edited by admin on Sat Dec 16 12:19:09 GMT 2023
PRIMARY
PUBCHEM
85085
Created by admin on Sat Dec 16 12:19:09 GMT 2023 , Edited by admin on Sat Dec 16 12:19:09 GMT 2023
PRIMARY
ECHA (EC/EINECS)
239-850-4
Created by admin on Sat Dec 16 12:19:09 GMT 2023 , Edited by admin on Sat Dec 16 12:19:09 GMT 2023
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EPA CompTox
DTXSID00166296
Created by admin on Sat Dec 16 12:19:09 GMT 2023 , Edited by admin on Sat Dec 16 12:19:09 GMT 2023
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