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

Details

Stereochemistry RACEMIC
Molecular Formula C15H17Cl2N3O
Molecular Weight 326.221
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of DINICONAZOLE

SMILES

CC(C)(C)C(O)C(=C/C1=C(Cl)C=C(Cl)C=C1)\N2C=NC=N2

InChI

InChIKey=FBOUIAKEJMZPQG-AWNIVKPZSA-N
InChI=1S/C15H17Cl2N3O/c1-15(2,3)14(21)13(20-9-18-8-19-20)6-10-4-5-11(16)7-12(10)17/h4-9,14,21H,1-3H3/b13-6+

HIDE SMILES / InChI
Molecular Formula C15H17Cl2N3O
Molecular Weight 326.221
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Approval Year

Unknown
149124
PubMed

PubMed

TitleDatePubMed
A high-throughput screen for teratogens using human pluripotent stem cells.
2014-01
Profiling 976 ToxCast chemicals across 331 enzymatic and receptor signaling assays.
2013-06-17
Environmental impact on vascular development predicted by high-throughput screening.
2011-11
Patents

Patents

04435203
2
04760149
3
04908455
3
05041651
3
05144071
3
05698742
3
JP2000336008A
4
JP2000336009A
9
JP2006525250A
40
JP2008509189A
189
JP2011246452A
8
JP2011509971A
151
JP2011511033A
33
JP2011527306A
56
JP4657199B2
31
JP4685035B2
15
JPH01226803A
1
JPH0789812A
5
JPS58208201A
1
JPS58208202A
1
JPS58210002A
1
JPS5951204A
1
JPS6153202A
1
JPS6153205A
1
JPS6153207A
1
JPS6163607A
1
JPS62195310A
1
JPS6229503A
1
JPS63183503A
1
JPS632907A
1
Substance Class Chemical
Created
by admin
on Mon Mar 31 19:02:18 GMT 2025
Edited
by admin
on Mon Mar 31 19:02:18 GMT 2025
Record UNII
X82HVO1N83
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DINICONAZOLE [ISO]
Preferred Name English
DINICONAZOLE
ISO   MI  
Common Name English
DINICONAZOLE [MI]
Common Name English
(E)-(RS)-1-(2,4-DICHLOROPHENYL)-4,4-DIMETHYL-2-(1H-1,2,4-TRIAZOL-1-YL)PENT-1-EN-3-OL
Systematic Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 128932
Created by admin on Mon Mar 31 19:02:18 GMT 2025 , Edited by admin on Mon Mar 31 19:02:18 GMT 2025
NCI_THESAURUS C514
Created by admin on Mon Mar 31 19:02:18 GMT 2025 , Edited by admin on Mon Mar 31 19:02:18 GMT 2025
Code System Code Type Description
PUBCHEM
6436605
Created by admin on Mon Mar 31 19:02:18 GMT 2025 , Edited by admin on Mon Mar 31 19:02:18 GMT 2025
PRIMARY
MESH
C049346
Created by admin on Mon Mar 31 19:02:18 GMT 2025 , Edited by admin on Mon Mar 31 19:02:18 GMT 2025
PRIMARY
MERCK INDEX
m4564
Created by admin on Mon Mar 31 19:02:18 GMT 2025 , Edited by admin on Mon Mar 31 19:02:18 GMT 2025
PRIMARY Merck Index
EPA CompTox
DTXSID2040363
Created by admin on Mon Mar 31 19:02:18 GMT 2025 , Edited by admin on Mon Mar 31 19:02:18 GMT 2025
PRIMARY
ALANWOOD
diniconazole
Created by admin on Mon Mar 31 19:02:18 GMT 2025 , Edited by admin on Mon Mar 31 19:02:18 GMT 2025
PRIMARY
FDA UNII
X82HVO1N83
Created by admin on Mon Mar 31 19:02:18 GMT 2025 , Edited by admin on Mon Mar 31 19:02:18 GMT 2025
PRIMARY
CAS
83657-24-3
Created by admin on Mon Mar 31 19:02:18 GMT 2025 , Edited by admin on Mon Mar 31 19:02:18 GMT 2025
PRIMARY
NCI_THESAURUS
C97992
Created by admin on Mon Mar 31 19:02:18 GMT 2025 , Edited by admin on Mon Mar 31 19:02:18 GMT 2025
PRIMARY
NIH
NCATS
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