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Details

Stereochemistry RACEMIC
Molecular Formula C12H14N4O
Molecular Weight 230.2658
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-ETHYL-2,6-DIIMINO-5-PHENYLTETRAHYDROPYRIMIDIN-4(1H)-ONE, (5RS)-

SMILES

CCC1(C(=N)NC(=N)NC1=O)C2=CC=CC=C2

InChI

InChIKey=ZKPNDYQXPJGNCR-UHFFFAOYSA-N
InChI=1S/C12H14N4O/c1-2-12(8-6-4-3-5-7-8)9(13)15-11(14)16-10(12)17/h3-7H,2H2,1H3,(H4,13,14,15,16,17)

HIDE SMILES / InChI

Molecular Formula C12H14N4O
Molecular Weight 230.2658
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 Sat Dec 16 10:55:18 GMT 2023
Edited
by admin
on Sat Dec 16 10:55:18 GMT 2023
Record UNII
56DGI011J7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-ETHYL-2,6-DIIMINO-5-PHENYLTETRAHYDROPYRIMIDIN-4(1H)-ONE, (5RS)-
Systematic Name English
(5H)-PYRIMIDINONE, 2,6-DIAMINO-5-ETHYL-5-PHENYL-
Systematic Name English
PHENOBARBITAL SODIUM IMPURITY A [EP IMPURITY]
Common Name English
PHENOBARBITAL IMPURITY A [EP IMPURITY]
Common Name English
(5RS)-5-ETHYL-2,6-DIIMINO-5-PHENYLTETRAHYDROPYRIMIDIN-4(1H)-ONE
Systematic Name English
2,6-DESOXO-2,6-DIIMINO-PHENOBARBITAL
Common Name English
PHENOBARBITAL RELATED COMPOUND A [USP-RS]
Common Name English
Code System Code Type Description
CAS
69125-70-8
Created by admin on Sat Dec 16 10:55:19 GMT 2023 , Edited by admin on Sat Dec 16 10:55:19 GMT 2023
PRIMARY
FDA UNII
56DGI011J7
Created by admin on Sat Dec 16 10:55:19 GMT 2023 , Edited by admin on Sat Dec 16 10:55:19 GMT 2023
PRIMARY
PUBCHEM
12457821
Created by admin on Sat Dec 16 10:55:19 GMT 2023 , Edited by admin on Sat Dec 16 10:55:19 GMT 2023
PRIMARY
RS_ITEM_NUM
1524012
Created by admin on Sat Dec 16 10:55:19 GMT 2023 , Edited by admin on Sat Dec 16 10:55:19 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP