Vitas-M small molecule compound

ethyl 6-amino-4-(2-chlorophenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate

Catalog ID
STK074445
SMILES CCOC(=O)C1=C(OC(=C(C1c1ccccc1Cl)C#N)N)c1ccccc1

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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 C21H17ClN2O3 MW 380.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2O3/c1-2-26-21(25)18-17(14-10-6-7-11-16(14)22)15(12-23)20(24)27-19(18)13-8-4-3-5-9-13/h3-11,17H,2,24H2,1H3
InChIKey
ORHWZJFAPBUCKS-UHFFFAOYSA-N
Synonyms
72916-31-5
4HPYRAN3CARBOXYLICACID6AMINO4(2CHLOROPHENYL)5CYANO2PHENYLETHYLESTER
72916315
CCOC(=O)C1=C(OC(=C(C1c1ccccc1Cl)C#N)N)c1ccccc1
CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2Cl)C#N)N)C3=CC=CC=C3
ETHYL6AMINO4(2CHLOROPHENYL)5CYANO2PHENYL4HPYRAN3CARBOXYLATE
InChI=1SC21H17ClN2O3c122621(25)1817(1410671116(14)22)15(1223)20(24)2719(18)138435913h31117H224H21H3
MFCD00581106
STK074445
ZINC000000627552
ZINC000000627554

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.