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Details

Stereochemistry ACHIRAL
Molecular Formula C20H20ClN5O2
Molecular Weight 397.858
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SD-0006

SMILES

OCC(=O)N1CCC(CC1)C2=NNC(=C2C3=NC=NC=C3)C4=CC=C(Cl)C=C4

InChI

InChIKey=CATQHDWESBRRQA-UHFFFAOYSA-N
InChI=1S/C20H20ClN5O2/c21-15-3-1-13(2-4-15)19-18(16-5-8-22-12-23-16)20(25-24-19)14-6-9-26(10-7-14)17(28)11-27/h1-5,8,12,14,27H,6-7,9-11H2,(H,24,25)

HIDE SMILES / InChI
Molecular Formula C20H20ClN5O2
Molecular Weight 397.858
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Sat Dec 16 12:54:50 UTC 2023
Edited
by admin
on Sat Dec 16 12:54:50 UTC 2023
Record UNII
C57VF8YO91
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SD-0006
Code English
N-(2-HYDROXYACETYL)-5-(4-PIPERIDYL)-4-(4-PYRIMIDINYL)-3-(4-CHLOROPHENYL)PYRAZOLE
Systematic Name English
SD-06
Code English
SD0006
Code English
ETHANONE, 1-(4-(5-(4-CHLOROPHENYL)-4-(4-PYRIMIDINYL)-1H-PYRAZOL-3-YL)-1-PIPERIDINYL)-2-HYDROXY-
Systematic Name English
1-(4-(5-(4-CHLOROPHENYL)-4-(4-PYRIMIDINYL)-1H-PYRAZOL-3-YL)-1-PIPERIDINYL)-2-HYDROXYETHANONE
Systematic Name English
PIPERIDINE, 4-(5-(4-CHLOROPHENYL)-4-(4-PYRIMIDINYL)-1H-PYRAZOL-3-YL)-1-(HYDROXYACETYL)-
Systematic Name English
1-(4-(3-(4-CHLOROPHENYL)-4-(4-PYRIMIDINYL)-1H-PYRAZOL-5-YL)-1-PIPERIDINYL)-2-HYDROXYETHANONE
Systematic Name English
Code System Code Type Description
ChEMBL
CHEMBL1090173
Created by admin on Sat Dec 16 12:54:50 UTC 2023 , Edited by admin on Sat Dec 16 12:54:50 UTC 2023
PRIMARY
CAS
1184301-42-5
Created by admin on Sat Dec 16 12:54:50 UTC 2023 , Edited by admin on Sat Dec 16 12:54:50 UTC 2023
ALTERNATIVE
PUBCHEM
9865587
Created by admin on Sat Dec 16 12:54:50 UTC 2023 , Edited by admin on Sat Dec 16 12:54:50 UTC 2023
PRIMARY
DRUG BANK
DB07943
Created by admin on Sat Dec 16 12:54:50 UTC 2023 , Edited by admin on Sat Dec 16 12:54:50 UTC 2023
PRIMARY
FDA UNII
C57VF8YO91
Created by admin on Sat Dec 16 12:54:50 UTC 2023 , Edited by admin on Sat Dec 16 12:54:50 UTC 2023
PRIMARY
CAS
271576-80-8
Created by admin on Sat Dec 16 12:54:50 UTC 2023 , Edited by admin on Sat Dec 16 12:54:50 UTC 2023
PRIMARY
EPA CompTox
DTXSID60432080
Created by admin on Sat Dec 16 12:54:50 UTC 2023 , Edited by admin on Sat Dec 16 12:54:50 UTC 2023
PRIMARY
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Related Record Type Details
Structure of SD-0006
ACTIVE MOIETY
NIH
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