Vitas-M small molecule compound
ethyl 6-amino-4-(3-bromophenyl)-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylate
Catalog ID
STK048226
SMILES CCOC(=O)C1=C(CCl)OC(=C(C1c1cccc(c1)Br)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 C16H14BrClN2O3 MW 397.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrClN2O3/c1-2-22-16(21)14-12(7-18)23-15(20)11(8-19)13(14)9-4-3-5-10(17)6-9/h3-6,13H,2,7,20H2,1H3InChIKey
UHJJCIKAPJSRMW-UHFFFAOYSA-NSynonyms
327070-64-4327070644
CCOC(=O)C1=C(CCl)OC(=C(C1c1cccc(c1)Br)C#N)N
CCOC(=O)C1=C(OC(=C(C1C2=CC(=CC=C2)Br)C#N)N)CCl
ETHYL(4R)6AMINO4(3BROMOPHENYL)2(CHLOROMETHYL)5CYANO4HPYRAN3CARBOXYLATE
ETHYL(4S)6AMINO4(3BROMOPHENYL)2(CHLOROMETHYL)5CYANO4HPYRAN3CARBOXYLATE
ETHYL6AMINO4(3BROMOPHENYL)2(CHLOROMETHYL)5CYANO4HPYRAN3CARBOXYLATE
InChI=1SC16H14BrClN2O3c122216(21)1412(718)2315(20)11(819)13(14)943510(17)69h3613H2720H21H3
MFCD00812120
STK048226
ZINC000001472189
ZINC000001472190
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