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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H17Cl2N3O
Molecular Weight 326.221
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of DINICONAZOLE, (+)-

SMILES

CC(C)(C)[C@H](O)C(=C/C1=CC=C(Cl)C=C1Cl)\N2C=NC=N2

InChI

InChIKey=FBOUIAKEJMZPQG-YGLIYXGISA-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+/t14-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H17Cl2N3O
Molecular Weight 326.221
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 08:25:35 GMT 2023
Edited
by admin
on Sat Dec 16 08:25:35 GMT 2023
Record UNII
HZM0U4P0K9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DINICONAZOLE, (+)-
Common Name English
(S)-DINICONAZOLE
Common Name English
(E)-(+)-1-(2,4-DICHLOROPHENYL)-2-(1,2,4-TRIAZOL-1-YL)-4,4-DIMETHYL-1-PENTEN-3-OL
Systematic Name English
(S)-S-3308
Code English
(+)-DINICONAZOLE
Common Name English
DINICONAZOLE (+)-FORM [MI]
Common Name English
1H-1,2,4-TRIAZOLE-1-ETHANOL, .BETA.-((2,4-DICHLOROPHENYL)METHYLENE)-.ALPHA.-(1,1-DIMETHYLETHYL)-, (.ALPHA.S,.BETA.E)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50273969
Created by admin on Sat Dec 16 08:25:35 GMT 2023 , Edited by admin on Sat Dec 16 08:25:35 GMT 2023
PRIMARY
MERCK INDEX
m4564
Created by admin on Sat Dec 16 08:25:35 GMT 2023 , Edited by admin on Sat Dec 16 08:25:35 GMT 2023
PRIMARY Merck Index
FDA UNII
HZM0U4P0K9
Created by admin on Sat Dec 16 08:25:35 GMT 2023 , Edited by admin on Sat Dec 16 08:25:35 GMT 2023
PRIMARY
PUBCHEM
6440729
Created by admin on Sat Dec 16 08:25:35 GMT 2023 , Edited by admin on Sat Dec 16 08:25:35 GMT 2023
PRIMARY
CAS
83657-19-6
Created by admin on Sat Dec 16 08:25:35 GMT 2023 , Edited by admin on Sat Dec 16 08:25:35 GMT 2023
PRIMARY
CHEBI
83906
Created by admin on Sat Dec 16 08:25:35 GMT 2023 , Edited by admin on Sat Dec 16 08:25:35 GMT 2023
PRIMARY