Vitas-M small molecule compound
methyl 6-amino-4-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-5-cyano-2-methyl-4H-pyran-3-carboxylate
Catalog ID
STL173722
SMILES COC(=O)C1=C(C)OC(=C(C1c1ccc(c(c1)COc1ccc(cc1Br)Cl)OC)C#N)N
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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 C23H20BrClN2O5 MW 519.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20BrClN2O5/c1-12-20(23(28)30-3)21(16(10-26)22(27)32-12)13-4-6-18(29-2)14(8-13)11-31-19-7-5-15(25)9-17(19)24/h4-9,21H,11,27H2,1-3H3InChIKey
FLGBRWWZPLUSDE-UHFFFAOYSA-NSynonyms
445232-63-3445232633
CC1=C(C(C(=C(O1)N)C#N)C2=CC(=C(C=C2)OC)COC3=C(C=C(C=C3)Cl)Br)C(=O)OC
InChI=1SC23H20BrClN2O5c11220(23(28)303)21(16(1026)22(27)3212)134618(292)14(813)1131197515(25)917(19)24h4921H1127H213H3
methyl6amino4(3((2bromo4chlorophenoxy)methyl)4methoxyphenyl)5cyano2methyl4Hpyran3carboxylate
MFCD02244049
ZINC000000649253
ZINC000000649255
Check stock
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Check stock on Vitas-MAvailable files
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