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Details

Stereochemistry ACHIRAL
Molecular Formula C4H11O4P.C3H8N2S
Molecular Weight 258.276
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of S-ETHYLISOTHIURONIUM DIETHYL PHOSPHATE

SMILES

CCSC(N)=N.CCOP(O)(=O)OCC

InChI

InChIKey=CSYSULGPHGCBQD-UHFFFAOYSA-N
InChI=1S/C4H11O4P.C3H8N2S/c1-3-7-9(5,6)8-4-2;1-2-6-3(4)5/h3-4H2,1-2H3,(H,5,6);2H2,1H3,(H3,4,5)

HIDE SMILES / InChI

Molecular Formula C4H11O4P
Molecular Weight 154.1015
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C3H8N2S
Molecular Weight 104.174
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 08:25:56 UTC 2023
Edited
by admin
on Sat Dec 16 08:25:56 UTC 2023
Record UNII
CTD25O6OBI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
S-ETHYLISOTHIURONIUM DIETHYL PHOSPHATE
Common Name English
PHOSPHORIC ACID, DIETHYL ESTER, COMPD. WITH 2-ETHYL-2-THIOPSEUDOUREA (1:1)
Systematic Name English
S-Ethylisothiouronium diethylphosphate [WHO-DD]
Common Name English
MTR-105
Code English
MTR 105
Code English
DIFETUR
Brand Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 514615
Created by admin on Sat Dec 16 08:25:56 UTC 2023 , Edited by admin on Sat Dec 16 08:25:56 UTC 2023
Code System Code Type Description
EVMPD
SUB194421
Created by admin on Sat Dec 16 08:25:56 UTC 2023 , Edited by admin on Sat Dec 16 08:25:56 UTC 2023
PRIMARY
FDA UNII
CTD25O6OBI
Created by admin on Sat Dec 16 08:25:56 UTC 2023 , Edited by admin on Sat Dec 16 08:25:56 UTC 2023
PRIMARY
SMS_ID
100000179842
Created by admin on Sat Dec 16 08:25:56 UTC 2023 , Edited by admin on Sat Dec 16 08:25:56 UTC 2023
PRIMARY
EPA CompTox
DTXSID60176093
Created by admin on Sat Dec 16 08:25:56 UTC 2023 , Edited by admin on Sat Dec 16 08:25:56 UTC 2023
PRIMARY
CAS
21704-46-1
Created by admin on Sat Dec 16 08:25:56 UTC 2023 , Edited by admin on Sat Dec 16 08:25:56 UTC 2023
PRIMARY
PUBCHEM
210823
Created by admin on Sat Dec 16 08:25:56 UTC 2023 , Edited by admin on Sat Dec 16 08:25:56 UTC 2023
PRIMARY
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ACTIVE MOIETY