FLUOXYTIOCONAZOLE

Details

Stereochemistry	RACEMIC
Molecular Formula	C23H15F4N5O2S
Molecular Weight	501.456
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(CN1N=CNC1=S)(C2=C(F)C=C(F)C=C2)C(F)(F)C3=CC=C(OC4=CC=C(C=C4)C#N)C=N3

InChI

InChIKey=KZOZKFJGERLOJN-UHFFFAOYSA-N

InChI=1S/C23H15F4N5O2S/c24-15-3-7-18(19(25)9-15)22(33,12-32-21(35)30-13-31-32)23(26,27)20-8-6-17(11-29-20)34-16-4-1-14(10-28)2-5-16/h1-9,11,13,33H,12H2,(H,30,31,35)

HIDE SMILES / InChI

Molecular Formula	C23H15F4N5O2S
Molecular Weight	501.456
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 18:42:19 GMT 2023` Edited by `admin` on `Sat Dec 16 18:42:19 GMT 2023`
Record UNII	GY52MR3JL5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

FLUOXYTIOCONAZOLE

Official Name

English

4-((6-(RAC-(2R)-2-(2,4-DIFLUOROPHENYL)-1,1-DIFLUORO-2-HYDROXY-3-(5-THIOXO-4H-1,2,4-TRIAZOL-1-YL)PROPYL)-3-PYRIDYL)OXY)BENZONITRILE

Systematic Name

English

BENZONITRILE, 4-((6-(2-(2,4-DIFLUOROPHENYL)-3-(2,5-DIHYDRO-5-THIOXO-1H-1,2,4-TRIAZOL-1-YL)-1,1-DIFLUORO-2-HYDROXYPROPYL)-3-PYRIDINYL)OXY)-

Systematic Name

English

4-((6-((2RS)-2-(2,4-DIFLUOROPHENYL)-1,1-DIFLUORO-2-HYDROXY-3-(5-MERCAPTO-1H-1,2,4-TRIAZOL-1-YL)PROPYL)-3-PYRIDYL)OXY)BENZONITRILE

Systematic Name

English

FLUOXYTIOCONAZOLE (ISO)

Common Name

English

4-((6-(2-(2,4-DIFLUOROPHENYL)-1,1-DIFLUORO-2-HYDROXY-3-(5-SULFANYL-1,2,4-TRIAZOL-1-YL)PROPYL)-3-PYRIDYL)OXY)BENZONITRILE

Systematic Name

English

4-((6-(2-(2,4-DIFLUOROPHENYL)-1,1-DIFLUORO-2-HYDROXY-3-(5-THIOXO-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-1-YL)PROPYL)PYRIDIN-3-YL)OXY)BENZONITRILE

Systematic Name

English

4-((6-(2-(2,4-DIFLUOROPHENYL)-1,1-DIFLUORO-2-HYDROXY-3-(5-MERCAPTO-1H-1,2,4-TRIAZOL-1-YL)PROPYL)PYRIDIN-3-YL)OXY)BENZONITRILE

Systematic Name

English

4-((6-(2-(2,4-DIFLUOROPHENYL)-3-(2,5-DIHYDRO-5-THIOXO-1H-1,2,4-TRIAZOL-1-YL)-1,1-DIFLUORO-2-HYDROXYPROPYL)-3-PYRIDINYL)OXY)BENZONITRILE

Systematic Name

English

RAC-4-((6-((2R)-2-(2,4-DIFLUOROPHENYL)-1,1-DIFLUORO-2-HYDROXY-3-(5-SULFANYL-1H-1,2,4-TRIAZOL-1-YL)PROPYL)PYRIDIN-3-YL)OXY)BENZONITRILE

Systematic Name

English

4-((6-(2-(2,4-DIFLUOROPHENYL)-1,1-DIFLUORO-2-HYDROXY-3-(5-THIOXO-4,5-DIHYDRO-1,2,4-TRIAZOL-1-YL)PROPYL)-3-PYRIDYL)OXY)BENZONITRILE

Systematic Name

English

Code System Code Type Description

CAS

2046300-61-0