Products 1246215-97-3

CAS 1246215-97-3 appears in our catalog under these names: Metazachlor Metabolite M09, Metazachlor-sulfinyl-acetic acid BH 479-9, Metazachlor Metabolite M09, Concentration: 100 µg/ml Solvent: Ethyl acetate. Offered by: Chemat Brand, Dr. Ehrenstorfer, HPC Standards. Available pack sizes: on request, 10mg, 1x1ml.

Metazachlor Metabolite M09
Chemat Brand
  • size: on request
  • Variants: 1
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Metazachlor-sulfinyl-acetic acid BH 479-9
Dr. Ehrenstorfer
  • size: 10mg
  • Variants: 1
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Metazachlor Metabolite M09, Concentration: 100 µg/ml Solvent: Ethyl acetate
HPC Standards
  • size: 1x1ml
  • Variants: 1
from 2321.38
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2-[2-[2,6-dimethyl-N-(pyrazol-1-ylmethyl)anilino]-2-oxoethyl]sulfinylacetic acid (CAS 1246215-97-3) is a chemical compound with the molecular formula C16H19N3O4S and a molecular weight of 349.4 g/mol. IUPAC name: 2-[2-[2,6-dimethyl-N-(pyrazol-1-ylmethyl)anilino]-2-oxoethyl]sulfinylacetic acid. InChIKey: DYCHUHSHQIYFAI-UHFFFAOYSA-N.

Identity
Molecular formulaC16H19N3O4S
Molecular weight349.4 g/mol
IUPAC name2-[2-[2,6-dimethyl-N-(pyrazol-1-ylmethyl)anilino]-2-oxoethyl]sulfinylacetic acid
InChIKeyDYCHUHSHQIYFAI-UHFFFAOYSA-N
SMILESCC1=C(C(=CC=C1)C)N(CN2C=CC=N2)C(=O)CS(=O)CC(=O)O

Computed by PubChem (NCBI)

Synonyms: 2-[2-[2,6-dimethyl-N-(pyrazol-1-ylmethyl)anilino]-2-oxoethyl]sulfinylacetic acid, 2-(2-(2,6-dimethyl-N-(pyrazol-1-ylmethyl)anilino)-2-oxoethyl)sulfinylacetic acid, Metazachlor BH 479-9, Metazachlor-sulfinyl-acetic acid BH 479-9, Metazachlor-sulfinyl-acetic acid BH 479-9 100 microg/mL in Acetonitrile
Isomers (same molecular formula)
2-[1-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-1-oxopropan-2-yl]sulfanylacetic acid C16H19N3O4S
(2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid C16H19N3O4S
(6R,7R)-7-[[(2R)-2-amino-2-cyclohexa-1,4-dien-1-ylacetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid C16H19N3O4S
(2S,5R,6R)-6-[[(2S)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid C16H19N3O4S
(4S)-2-(3,6-dioxo-5-phenylpiperazin-2-yl)-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid C16H19N3O4S
ethyl 2-amino-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)thiophene-3-carboxylate C16H19N3O4S
(6R,7R)-7-[[(2S)-2-amino-2-cyclohexa-1,4-dien-1-ylacetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid C16H19N3O4S
(2S,5R,6R)-6-[[(2R)-2-amino-2-(2,3,4,5,6-pentadeuteriophenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid C16H19N3O4S
(6R,7R)-7-[[(2R)-2-amino-2-cyclohexa-1,4-dien-1-ylacetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid C16H19N3O4S
(2S,5R,6S)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid C16H19N3O4S