(R)-pyrimisulfan (CHEBI:143523)

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ChEBI Name	(R)-pyrimisulfan

ChEBI ID	CHEBI:143523

ChEBI ASCII Name	(R)-pyrimisulfan

Definition	A N-{2-[(4,6-dimethoxypyrimidin-2-yl)(hydroxy)methyl]-6-(methoxymethyl)phenyl}-1,1-difluoromethanesulfonamide that has R configuration.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C16H19F2N3O6S

Net Charge

Average Mass

419.400

Monoisotopic Mass

419.09626

InChI

InChI=1S/C16H19F2N3O6S/c1-25-8-9-5-4-6-10(13(9)21-28(23,24)16(17)18)14(22)15-19-11(26-2)7-12(20-15)27-3/h4-7,14,16,21-22H,8H2,1-3H3/t14-/m1/s1

InChIKey

NTBVTCXMRYKRTB-CQSZACIVSA-N

SMILES

O(CC1=C(NS(=O)(=O)C(F)F)C([C@H](C=2N=C(OC)C=C(OC)N2)O)=CC=C1)C

Roles Classification
Application(s):	pesticide Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. (via organofluorine pesticide )

ChEBI Ontology
Outgoing	(R)-pyrimisulfan (CHEBI:143523) is a N-{2-[(4,6-dimethoxypyrimidin-2-yl)(hydroxy)methyl]-6-(methoxymethyl)phenyl}-1,1-difluoromethanesulfonamide (CHEBI:143522) (R)-pyrimisulfan (CHEBI:143523) is enantiomer of (S)-pyrimisulfan (CHEBI:143524)

Incoming	pyrimisulfan (CHEBI:143521) has part (R)-pyrimisulfan (CHEBI:143523) (S)-pyrimisulfan (CHEBI:143524) is enantiomer of (R)-pyrimisulfan (CHEBI:143523)

IUPAC Name

N-{2-[(R)-(4,6-dimethoxypyrimidin-2-yl)(hydroxy)methyl]-6-(methoxymethyl)phenyl}-1,1-difluoromethanesulfonamide

Last Modified

05 April 2019