(Q27156718)

English

(RS)-oxathiapiprolin

group of stereoisomers

1-(4-{4-[5-(2,6-difluorophenyl)-4,5-dihydro-1,2-oxazol-3-yl]-1,3-thiazol-2-yl}piperidin-1-yl)-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethanone

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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chemical structure

Oxathiapiprolin skeletal.svg
1,100 × 365; 56 KB

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mass

539.141±0 dalton

1 reference

language of work or name

English

title

Oxathiapiprolin (English)

retrieved

9 October 2016

chemical formula

C₂₄H₂₂F₅N₅O₂S

2 references

language of work or name

English

title

Oxathiapiprolin (English)

retrieved

9 October 2016

imported from Wikimedia project

German Wikipedia

canonical SMILES

CC1=CC(=NN1CC(=O)N2CCC(CC2)C3=NC(=CS3)C4=NOC(C4)C5=C(C=CC=C5F)F)C(F)(F)F

1 reference

language of work or name

English

title

Oxathiapiprolin (English)

9 October 2016

racemate and a group of stereoisomers (structure with undefined spatial configuration) should be described in different items

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Identifiers

InChI

InChI=1S/C24H22F5N5O2S/c1-13-9-20(24(27,28)29)31-34(13)11-21(35)33-7-5-14(6-8-33)23-30-18(12-37-23)17-10-19(36-32-17)22-15(25)3-2-4-16(22)26/h2-4,9,12,14,19H,5-8,10-11H2,1H3

1 reference

language of work or name

English

title

Oxathiapiprolin (English)

retrieved

9 October 2016

InChIKey

IAQLCKZJGNTRDO-UHFFFAOYSA-N

2 references

language of work or name

English

title

Oxathiapiprolin (English)

retrieved

9 October 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

1003318-67-9

1 reference

stated in

CAS (formerly Chemical Abstracts Service)

25 January 2022

1 reference

language of work or name

English

title

oxathiapiprolin (prov) (English)

9 October 2016

1 reference

language of work or name

English

title

Oxathiapiprolin (English)

retrieved

9 October 2016

ChEBI ID

83271

mapping relation type

1 reference

language of work or name

English

title

1-(4-{4-[5-(2,6-difluorophenyl)-4,5-dihydro-1,2-oxazol-3-yl]-1,3-thiazol-2-yl}piperidin-1-yl)-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethanone (English)

9 October 2016

1 reference

0 references

DSSTOX compound identifier

DTXCID001323631