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Details

Stereochemistry UNKNOWN
Molecular Formula C15H20ClN3O2
Molecular Weight 309.791
Optical Activity ( + )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

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

SMILES

CC(C)(C)C(O)(COC1=CC=C(Cl)C=C1)CN2C=NC=N2

InChI

InChIKey=OCQPZTCGZAFWSG-UHFFFAOYSA-N
InChI=1S/C15H20ClN3O2/c1-14(2,3)15(20,8-19-11-17-10-18-19)9-21-13-6-4-12(16)5-7-13/h4-7,10-11,20H,8-9H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C15H20ClN3O2
Molecular Weight 309.791
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 13:46:10 GMT 2023
Edited
by admin
on Sat Dec 16 13:46:10 GMT 2023
Record UNII
S72S9RVE68
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VIBUNAZOLE, (+)-
Common Name English
1H-1,2,4-TRIAZOLE-1-ETHANOL, .ALPHA.-((4-CHLOROPHENOXY)METHYL)-.ALPHA.-(1,1-DIMETHYLETHYL)-, (+)-
Systematic Name English
BAY-R-2303
Code English
(+)-.ALPHA.-((4-CHLOROPHENOXY)METHYL)-.ALPHA.-(1,1-DIMETHYLETHYL)-1H-1,2,4-TRIAZOLE-1-ETHANOL
Systematic Name English
Code System Code Type Description
CAS
104358-26-1
Created by admin on Sat Dec 16 13:46:10 GMT 2023 , Edited by admin on Sat Dec 16 13:46:10 GMT 2023
PRIMARY
FDA UNII
S72S9RVE68
Created by admin on Sat Dec 16 13:46:10 GMT 2023 , Edited by admin on Sat Dec 16 13:46:10 GMT 2023
PRIMARY
PUBCHEM
123676
Created by admin on Sat Dec 16 13:46:10 GMT 2023 , Edited by admin on Sat Dec 16 13:46:10 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER