Vitas-M small molecule compound

methyl (2Z)-3-(1,3-benzodioxol-5-ylmethyl)-2-[(3-chloro-4-fluorophenyl)imino]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxylate

Catalog ID
STK776748
SMILES COC(=O)c1s/c(=N\c2ccc(c(c2)Cl)F)/n(c(=O)c1)Cc1ccc2c(c1)OCO2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H14ClFN2O5S MW 448.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14ClFN2O5S/c1-27-19(26)17-8-18(25)24(9-11-2-5-15-16(6-11)29-10-28-15)20(30-17)23-12-3-4-14(22)13(21)7-12/h2-8H,9-10H2,1H3/b23-20-
InChIKey
PFIPZXXQTWUFKP-ATJXCDBQSA-N
Synonyms

COC(=O)c1sc(=Nc2ccc(c(c2)Cl)F)n(c(=O)c1)Cc1ccc2c(c1)OCO2
methyl(2Z)3(13benzodioxol5ylmethyl)2((3chloro4fluorophenyl)imino)4oxo34dihydro2H13thiazine6carboxylate
MFCD05259506
ZINC000013879208

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Available files

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