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Details

Stereochemistry RACEMIC
Molecular Formula C21H21ClN2O
Molecular Weight 352.857
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PK-11195

SMILES

CCC(C)N(C)C(=O)C1=NC(=C2C=CC=CC2=C1)C3=C(Cl)C=CC=C3

InChI

InChIKey=RAVIZVQZGXBOQO-UHFFFAOYSA-N
InChI=1S/C21H21ClN2O/c1-4-14(2)24(3)21(25)19-13-15-9-5-6-10-16(15)20(23-19)17-11-7-8-12-18(17)22/h5-14H,4H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C21H21ClN2O
Molecular Weight 352.857
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 10:06:06 UTC 2023
Edited
by admin
on Sat Dec 16 10:06:06 UTC 2023
Record UNII
YNF83VN1RL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PK-11195
Common Name English
RP-52028
Code English
PK 11195
Common Name English
3-ISOQUINOLINECARBOXAMIDE, 1-(2-CHLOROPHENYL)-N-METHYL-N-(1-METHYLPROPYL)-
Systematic Name English
N-METHYL-N-(1-METHYLPROPYL)-1-(2-CHLOROPHENYL)ISOQUINOLINE-3-CARBOXAMIDE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID7041097
Created by admin on Sat Dec 16 10:06:07 UTC 2023 , Edited by admin on Sat Dec 16 10:06:07 UTC 2023
PRIMARY
PUBCHEM
1345
Created by admin on Sat Dec 16 10:06:07 UTC 2023 , Edited by admin on Sat Dec 16 10:06:07 UTC 2023
PRIMARY
WIKIPEDIA
PK-11195
Created by admin on Sat Dec 16 10:06:07 UTC 2023 , Edited by admin on Sat Dec 16 10:06:07 UTC 2023
PRIMARY
FDA UNII
YNF83VN1RL
Created by admin on Sat Dec 16 10:06:07 UTC 2023 , Edited by admin on Sat Dec 16 10:06:07 UTC 2023
PRIMARY
CAS
85532-75-8
Created by admin on Sat Dec 16 10:06:07 UTC 2023 , Edited by admin on Sat Dec 16 10:06:07 UTC 2023
PRIMARY
Related Record Type Details
LABELED -> NON-LABELED
LABELED -> NON-LABELED
Related Record Type Details
ACTIVE MOIETY