Vitas-M small molecule compound
methyl 6-amino-4-(4-bromophenyl)-5-cyano-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylate
Catalog ID
STK043588
SMILES COC(=O)C1=C(CC(=O)OC)OC(=C(C1c1ccc(cc1)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 C17H15BrN2O5 MW 407.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN2O5/c1-23-13(21)7-12-15(17(22)24-2)14(11(8-19)16(20)25-12)9-3-5-10(18)6-4-9/h3-6,14H,7,20H2,1-2H3InChIKey
PXZGNGVADZIYNL-UHFFFAOYSA-NSynonyms
371956-76-2371956762
COC(=O)C1=C(CC(=O)OC)OC(=C(C1c1ccc(cc1)Br)C#N)N
COC(=O)CC1=C(C(C(=C(O1)N)C#N)C2=CC=C(C=C2)Br)C(=O)OC
InChI=1SC17H15BrN2O5c12313(21)71215(17(22)242)14(11(819)16(20)2512)93510(18)649h3614H720H212H3
METHYL(4R)6AMINO4(4BROMOPHENYL)5CYANO2(2METHOXY2OXOETHYL)4HPYRAN3CARBOXYLATE
METHYL(4S)6AMINO4(4BROMOPHENYL)5CYANO2(2METHOXY2OXOETHYL)4HPYRAN3CARBOXYLATE
METHYL6AMINO4(4BROMOPHENYL)5CYANO2(2METHOXY2OXOETHYL)4HPYRAN3CARBOXYLATE
MFCD01605394
STK043588
ZINC000002270146
ZINC000002270147
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