Vitas-M small molecule compound
benzyl 6-amino-5-cyano-4-(2-iodophenyl)-2-methyl-4H-pyran-3-carboxylate
Catalog ID
STK669697
SMILES N#CC1=C(N)OC(=C(C1c1ccccc1I)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 C21H17IN2O3 MW 472.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17IN2O3/c1-13-18(21(25)26-12-14-7-3-2-4-8-14)19(16(11-23)20(24)27-13)15-9-5-6-10-17(15)22/h2-10,19H,12,24H2,1H3InChIKey
QGEGKWKJUACDAZ-UHFFFAOYSA-NSynonyms
benzyl6amino5cyano4(2iodophenyl)2methyl4Hpyran3carboxylate
CC1=C(C(C(=C(O1)N)C#N)C2=CC=CC=C2I)C(=O)OCC3=CC=CC=C3
InChI=1SC21H17IN2O3c11318(21(25)2612147324814)19(16(1123)20(24)2713)159561017(15)22h21019H1224H21H3
MFCD00744599
ZINC000000705960
ZINC000000705961
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