Vitas-M small molecule compound
methyl 6-amino-4-{3-[(4-chloro-2-methylphenoxy)methyl]-2,5-dimethylphenyl}-5-cyano-2-methyl-4H-pyran-3-carboxylate
Catalog ID
STL176473
SMILES COC(=O)C1=C(C)OC(=C(C1c1cc(C)cc(c1C)COc1ccc(cc1C)Cl)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 C25H25ClN2O4 MW 452.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN2O4/c1-13-8-17(12-31-21-7-6-18(26)10-14(21)2)15(3)19(9-13)23-20(11-27)24(28)32-16(4)22(23)25(29)30-5/h6-10,23H,12,28H2,1-5H3InChIKey
DKUAPTMWDRPSDN-UHFFFAOYSA-NSynonyms
678150-94-2678150942
CC1=CC(=C(C(=C1)C2C(=C(OC(=C2C(=O)OC)C)N)C#N)C)COC3=C(C=C(C=C3)Cl)C
InChI=1SC25H25ClN2O4c113817(1231217618(26)1014(21)2)15(3)19(913)2320(1127)24(28)3216(4)22(23)25(29)305h61023H1228H215H3
methyl6amino4(3((4chloro2methylphenoxy)methyl)25dimethylphenyl)5cyano2methyl4Hpyran3carboxylate
MFCD03883598
ZINC000001111359
ZINC000001111360
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.