Vitas-M small molecule compound

methyl 6-amino-4-(2-chloro-6-fluorophenyl)-5-cyano-2-(methoxymethyl)-4H-pyran-3-carboxylate

Catalog ID
STK755341
SMILES COCC1=C(C(=O)OC)C(C(=C(O1)N)C#N)c1c(F)cccc1Cl

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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 C16H14ClFN2O4 MW 352.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClFN2O4/c1-22-7-11-14(16(21)23-2)12(8(6-19)15(20)24-11)13-9(17)4-3-5-10(13)18/h3-5,12H,7,20H2,1-2H3
InChIKey
ATGRANRHFWYYCG-UHFFFAOYSA-N
Synonyms

COCC1=C(C(C(=C(O1)N)C#N)C2=C(C=CC=C2Cl)F)C(=O)OC
InChI=1SC16H14ClFN2O4c12271114(16(21)232)12(8(619)15(20)2411)139(17)43510(13)18h3512H720H212H3
methyl6amino4(2chloro6fluorophenyl)5cyano2(methoxymethyl)4Hpyran3carboxylate
MFCD00827850
ZINC000004189076
ZINC000004189078

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Available files

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