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

Details

Stereochemistry ACHIRAL
Molecular Formula C14H13Cl2N5
Molecular Weight 322.193
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ST-39008 FREE BASE

SMILES

ClC1=CC=C(NC(=N)NC(=N)NC2=CC=C(Cl)C=C2)C=C1

InChI

InChIKey=WACUTUAJONDJMA-UHFFFAOYSA-N
InChI=1S/C14H13Cl2N5/c15-9-1-5-11(6-2-9)19-13(17)21-14(18)20-12-7-3-10(16)4-8-12/h1-8H,(H5,17,18,19,20,21)

HIDE SMILES / InChI

Molecular Formula C14H13Cl2N5
Molecular Weight 322.193
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 10:55:21 UTC 2023
Edited
by admin
on Sat Dec 16 10:55:21 UTC 2023
Record UNII
UV9L7Y722Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ST-39008 FREE BASE
Common Name English
N1,N3-BIS(4-CHLOROPHENYL)IMIDODICARBONIMIDIC DIAMIDE
Systematic Name English
PROGUANIL HYDROCHLORIDE IMPURITY C [EP IMPURITY]
Common Name English
PROGUANIL RELATED COMPOUND C FREE BASE
Common Name English
PROGUANIL RELATED COMPOUND C (FREE BASE)
Common Name English
IMIDODICARBONIMIDIC DIAMIDE, N,N'-BIS(4-CHLOROPHENYL)-
Systematic Name English
PROGUANIL HYDROCHLORIDE RELATED COMPOUND C [USP IMPURITY]
Common Name English
1,5-BIS(4-CHLOROPHENYL)BIGUANIDE
Systematic Name English
Code System Code Type Description
FDA UNII
UV9L7Y722Z
Created by admin on Sat Dec 16 10:55:22 UTC 2023 , Edited by admin on Sat Dec 16 10:55:22 UTC 2023
PRIMARY
CAS
13590-88-0
Created by admin on Sat Dec 16 10:55:22 UTC 2023 , Edited by admin on Sat Dec 16 10:55:22 UTC 2023
PRIMARY
PUBCHEM
53307390
Created by admin on Sat Dec 16 10:55:22 UTC 2023 , Edited by admin on Sat Dec 16 10:55:22 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP