U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C17H19ClN4
Molecular Weight 314.813
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of LORCINADOL

SMILES

ClC1=NN=C(C=C1)N2CCN(C\C=C\C3=CC=CC=C3)CC2

InChI

InChIKey=NCPBMOFVRBEVJY-QPJJXVBHSA-N
InChI=1S/C17H19ClN4/c18-16-8-9-17(20-19-16)22-13-11-21(12-14-22)10-4-7-15-5-2-1-3-6-15/h1-9H,10-14H2/b7-4+

HIDE SMILES / InChI

Molecular Formula C17H19ClN4
Molecular Weight 314.813
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:27:18 GMT 2023
Edited
by admin
on Fri Dec 15 16:27:18 GMT 2023
Record UNII
S1IC65Y242
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LORCINADOL
INN   USAN  
USAN   INN  
Official Name English
(E)-3-Chloro-6-(4-cinnamyl-1-piperazinyl)pyridazine
Systematic Name English
R-62-818
Code English
lorcinadol [INN]
Common Name English
R 62818
Code English
LORCINADOL [USAN]
Common Name English
PYRIDAZINE, 3-CHLORO-6-(4-(3-PHENYL-2-PROPENYL)-1-PIPERAZINYL)-, (E)-
Common Name English
R 62 818
Code English
Classification Tree Code System Code
NCI_THESAURUS C241
Created by admin on Fri Dec 15 16:27:18 GMT 2023 , Edited by admin on Fri Dec 15 16:27:18 GMT 2023
Code System Code Type Description
FDA UNII
S1IC65Y242
Created by admin on Fri Dec 15 16:27:18 GMT 2023 , Edited by admin on Fri Dec 15 16:27:18 GMT 2023
PRIMARY
PUBCHEM
6436126
Created by admin on Fri Dec 15 16:27:18 GMT 2023 , Edited by admin on Fri Dec 15 16:27:18 GMT 2023
PRIMARY
INN
6105
Created by admin on Fri Dec 15 16:27:18 GMT 2023 , Edited by admin on Fri Dec 15 16:27:18 GMT 2023
PRIMARY
USAN
BB-22
Created by admin on Fri Dec 15 16:27:18 GMT 2023 , Edited by admin on Fri Dec 15 16:27:18 GMT 2023
PRIMARY
EVMPD
SUB08585MIG
Created by admin on Fri Dec 15 16:27:18 GMT 2023 , Edited by admin on Fri Dec 15 16:27:18 GMT 2023
PRIMARY
ChEMBL
CHEMBL2106757
Created by admin on Fri Dec 15 16:27:18 GMT 2023 , Edited by admin on Fri Dec 15 16:27:18 GMT 2023
PRIMARY
CAS
104719-71-3
Created by admin on Fri Dec 15 16:27:18 GMT 2023 , Edited by admin on Fri Dec 15 16:27:18 GMT 2023
PRIMARY
EPA CompTox
DTXSID50883148
Created by admin on Fri Dec 15 16:27:18 GMT 2023 , Edited by admin on Fri Dec 15 16:27:18 GMT 2023
PRIMARY
SMS_ID
100000082032
Created by admin on Fri Dec 15 16:27:18 GMT 2023 , Edited by admin on Fri Dec 15 16:27:18 GMT 2023
PRIMARY
NCI_THESAURUS
C66035
Created by admin on Fri Dec 15 16:27:18 GMT 2023 , Edited by admin on Fri Dec 15 16:27:18 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY