Products 1885094-63-2

CAS 1885094-63-2 is the registry number for 1-(5-(4-Fluorophenyl)-1-(pyridin-3-ylsulfonyl)-1H-pyrrol-3-yl)-N-methylmethanamine fumarate, 95%. Offered by: Chemat Brand. Available pack sizes: on request.

1-(5-(4-Fluorophenyl)-1-(pyridin-3-ylsulfonyl)-1H-pyrrol-3-yl)-N-methylmethanamine fumarate, 95%
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

(E)-but-2-enedioic acid;1-[5-(4-fluorophenyl)-1-pyridin-3-ylsulfonylpyrrol-3-yl]-N-methylmethanamine (CAS 1885094-63-2) is a chemical compound with the molecular formula C21H20FN3O6S and a molecular weight of 461.5 g/mol. IUPAC name: (E)-but-2-enedioic acid;1-[5-(4-fluorophenyl)-1-pyridin-3-ylsulfonylpyrrol-3-yl]-N-methylmethanamine. InChIKey: AOBKJCUEFDMZDE-WLHGVMLRSA-N.

Identity
Molecular formulaC21H20FN3O6S
Molecular weight461.5 g/mol
IUPAC name(E)-but-2-enedioic acid;1-[5-(4-fluorophenyl)-1-pyridin-3-ylsulfonylpyrrol-3-yl]-N-methylmethanamine
InChIKeyAOBKJCUEFDMZDE-WLHGVMLRSA-N
SMILESCNCC1=CN(C(=C1)C2=CC=C(C=C2)F)S(=O)(=O)C3=CN=CC=C3.C(=C/C(=O)O)\C(=O)O

Computed by PubChem (NCBI)

Synonyms: Vonoprazan Impurity 13, 881733-36-4free base, Vonoprazan Fumarate impurity 44
Isomers (same molecular formula)
2-[[5-(2-fluorophenyl)-1-pyridin-3-ylsulfonylpyrrol-3-yl]methyl-methylamino]butanedioic acid C21H20FN3O6S
7-fluoro-8-[4-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl]piperazin-1-yl]-5-oxo-1,2-dihydro-[1,3]thiazolo[3,2-a]quinoline-4-carboxylic acid C21H20FN3O6S
6-fluoro-1-methyl-4-oxo-7-[4-(3-oxobut-1-en-2-yloxycarbonyl)piperazin-1-yl]-1H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid C21H20FN3O6S
(E)-but-2-enedioic acid;1-[5-(2-fluorophenyl)-1-pyridin-3-ylsulfonylpyrrol-3-yl]-N-methylmethanamine C21H20FN3O6S
(E)-but-2-enedioic acid;1-[5-(2-fluorophenyl)-1-pyridin-3-ylsulfonylpyrrol-3-yl]-N-methylmethanamine C21H20FN3O6S
6-fluoro-1-methyl-7-[4-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl]piperazin-1-yl]-4-oxo-1H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid C21H20FN3O6S