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Details

Stereochemistry ACHIRAL
Molecular Formula C20H24N4O4
Molecular Weight 384.429
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 8-[(1E)-2-(3,4-Dimethoxyphenyl)ethenyl]-1,3-diethyl-3,9-dihydro-9-methyl-1H-purine-2,6-dione

SMILES

CCN1C2=C(N=C(\C=C\C3=CC(OC)=C(OC)C=C3)N2C)C(=O)N(CC)C1=O

InChI

InChIKey=SQZPAIQKTOGPPA-PKNBQFBNSA-N
InChI=1S/C20H24N4O4/c1-6-23-18-17(19(25)24(7-2)20(23)26)21-16(22(18)3)11-9-13-8-10-14(27-4)15(12-13)28-5/h8-12H,6-7H2,1-5H3/b11-9+

HIDE SMILES / InChI

Molecular Formula C20H24N4O4
Molecular Weight 384.429
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:52:15 GMT 2023
Edited
by admin
on Sat Dec 16 19:52:15 GMT 2023
Record UNII
9GJX66QN5Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8-[(1E)-2-(3,4-Dimethoxyphenyl)ethenyl]-1,3-diethyl-3,9-dihydro-9-methyl-1H-purine-2,6-dione
Systematic Name English
1H-Purine-2,6-dione, 8-[(1E)-2-(3,4-dimethoxyphenyl)ethenyl]-1,3-diethyl-3,9-dihydro-9-methyl
Systematic Name English
Istradefylline Impurity 7
Common Name English
Code System Code Type Description
CAS
1453190-01-6
Created by admin on Sat Dec 16 19:52:15 GMT 2023 , Edited by admin on Sat Dec 16 19:52:15 GMT 2023
PRIMARY
FDA UNII
9GJX66QN5Z
Created by admin on Sat Dec 16 19:52:15 GMT 2023 , Edited by admin on Sat Dec 16 19:52:15 GMT 2023
PRIMARY