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

Details

Stereochemistry ABSOLUTE
Molecular Formula C13H19N5
Molecular Weight 245.3235
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of PINACIDIL ANHYDROUS, (S)-

SMILES

C[C@H](NC(NC1=CC=NC=C1)=NC#N)C(C)(C)C

InChI

InChIKey=IVVNZDGDKPTYHK-JTQLQIEISA-N
InChI=1S/C13H19N5/c1-10(13(2,3)4)17-12(16-9-14)18-11-5-7-15-8-6-11/h5-8,10H,1-4H3,(H2,15,16,17,18)/t10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H19N5
Molecular Weight 245.3235
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:48:47 GMT 2023
Edited
by admin
on Sat Dec 16 11:48:47 GMT 2023
Record UNII
Y08IPB8MZH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PINACIDIL ANHYDROUS, (S)-
Common Name English
GUANIDINE, N-CYANO-N'-4-PYRIDINYL-N''-((1S)-1,2,2-TRIMETHYLPROPYL)-
Systematic Name English
GUANIDINE, N-CYANO-N'-4-PYRIDINYL-N''-(1,2,2-TRIMETHYLPROPYL)-, (S)-
Common Name English
(+)-PINACIDIL
Common Name English
(S)-PINACIDIL
Common Name English
Code System Code Type Description
FDA UNII
Y08IPB8MZH
Created by admin on Sat Dec 16 11:48:47 GMT 2023 , Edited by admin on Sat Dec 16 11:48:47 GMT 2023
PRIMARY
CAS
113563-70-5
Created by admin on Sat Dec 16 11:48:47 GMT 2023 , Edited by admin on Sat Dec 16 11:48:47 GMT 2023
PRIMARY
PUBCHEM
6603960
Created by admin on Sat Dec 16 11:48:47 GMT 2023 , Edited by admin on Sat Dec 16 11:48:47 GMT 2023
PRIMARY
Related Record Type Details
SOLVATE->ANHYDROUS