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Details

Stereochemistry ACHIRAL
Molecular Formula C12H12ClN3O.ClH
Molecular Weight 286.157
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-AMINO-5-(4-CHLOROPHENYL)-6-ETHYLPYRIMIDIN-4(3H)-ONE HYDROCHLORIDE

SMILES

Cl.CCC1=C(C(=O)N=C(N)N1)C2=CC=C(Cl)C=C2

InChI

InChIKey=AWVPJIDNGHBMHH-UHFFFAOYSA-N
InChI=1S/C12H12ClN3O.ClH/c1-2-9-10(11(17)16-12(14)15-9)7-3-5-8(13)6-4-7;/h3-6H,2H2,1H3,(H3,14,15,16,17);1H

HIDE SMILES / InChI

Molecular Formula C12H12ClN3O
Molecular Weight 249.696
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
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 18:35:52 GMT 2023
Edited
by admin
on Sat Dec 16 18:35:52 GMT 2023
Record UNII
W44VNW6KMU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-AMINO-5-(4-CHLOROPHENYL)-6-ETHYLPYRIMIDIN-4(3H)-ONE HYDROCHLORIDE
Systematic Name English
4(3H)-PYRIMIDINONE, 2-AMINO-5-(4-CHLOROPHENYL)-6-ETHYL-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
155804634
Created by admin on Sat Dec 16 18:35:52 GMT 2023 , Edited by admin on Sat Dec 16 18:35:52 GMT 2023
PRIMARY PUBCHEM
FDA UNII
W44VNW6KMU
Created by admin on Sat Dec 16 18:35:52 GMT 2023 , Edited by admin on Sat Dec 16 18:35:52 GMT 2023
PRIMARY
CAS
104498-88-6
Created by admin on Sat Dec 16 18:35:52 GMT 2023 , Edited by admin on Sat Dec 16 18:35:52 GMT 2023
PRIMARY
Related Record Type Details
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