Vitas-M small molecule compound
benzyl 6-amino-4-(4-chlorophenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate
Catalog ID
STK748655
SMILES N#CC1=C(N)OC(=C(C1c1ccc(cc1)Cl)C(=O)OCc1ccccc1)C
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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/c1-13-18(21(25)26-12-14-5-3-2-4-6-14)19(17(11-23)20(24)27-13)15-7-9-16(22)10-8-15/h2-10,19H,12,24H2,1H3InChIKey
ZGJZCMUIDDOXPT-UHFFFAOYSA-NSynonyms
339580-97-1339580971
4HPYRANE3CARBOXYLICACID6AMINO4(4CHLOROPHENYL)5CYANO2METHYLBENZYLESTER
benzyl6amino4(4chlorophenyl)5cyano2methyl4Hpyran3carboxylate
CC1=C(C(C(=C(O1)N)C#N)C2=CC=C(C=C2)Cl)C(=O)OCC3=CC=CC=C3
InChI=1SC21H17ClN2O3c11318(21(25)2612145324614)19(17(1123)20(24)2713)157916(22)10815h21019H1224H21H3
MFCD00743645
ZINC000000705926
ZINC000000705927
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