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Details

Stereochemistry MIXED
Molecular Formula C13H19N4O6PS2
Molecular Weight 422.417
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 2
Charge 0
Stereo Comments Assumed mixed

SHOW SMILES / InChI
Structure of CGP-19984 FREE ACID

SMILES

COP(O)(=O)OC1SC(=NN=C2SC(C)C(=O)N2CC(C)=C)N(C)C1=O

InChI

InChIKey=ODWWLZZJQZIJGP-DZDAAMPGSA-N
InChI=1S/C13H19N4O6PS2/c1-7(2)6-17-9(18)8(3)25-13(17)15-14-12-16(4)10(19)11(26-12)23-24(20,21)22-5/h8,11H,1,6H2,2-5H3,(H,20,21)/b14-12-,15-13-

HIDE SMILES / InChI

Molecular Formula C13H19N4O6PS2
Molecular Weight 422.417
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:50:57 GMT 2023
Edited
by admin
on Sat Dec 16 14:50:57 GMT 2023
Record UNII
LK4D002VJ2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CGP-19984 FREE ACID
Code English
PHOSPHORIC ACID, MONOMETHYL MONO(3-METHYL-2-((5-METHYL-3-(2-METHYL-2-PROPENYL)-4-OXO-2-THIAZOLIDINYLIDENE)HYDRAZONO)-4-OXO-5-THIAZOLIDINYL) ESTER
Systematic Name English
Code System Code Type Description
CAS
87958-63-2
Created by admin on Sat Dec 16 14:50:57 GMT 2023 , Edited by admin on Sat Dec 16 14:50:57 GMT 2023
PRIMARY
PUBCHEM
132685
Created by admin on Sat Dec 16 14:50:57 GMT 2023 , Edited by admin on Sat Dec 16 14:50:57 GMT 2023
PRIMARY
FDA UNII
LK4D002VJ2
Created by admin on Sat Dec 16 14:50:57 GMT 2023 , Edited by admin on Sat Dec 16 14:50:57 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT