Vitas-M small molecule compound
ethyl 2-amino-4-{5-[(3-bromophenoxy)methyl]furan-2-yl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Catalog ID
STK961006
SMILES CCOC(=O)C1=C(N)OC2=C(C1c1ccc(o1)COc1cccc(c1)Br)C(=O)CC(C2)(C)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 C25H26BrNO6 MW 516.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26BrNO6/c1-4-30-24(29)22-21(20-17(28)11-25(2,3)12-19(20)33-23(22)27)18-9-8-16(32-18)13-31-15-7-5-6-14(26)10-15/h5-10,21H,4,11-13,27H2,1-3H3InChIKey
UPBMLFYUOLYEQL-UHFFFAOYSA-NSynonyms
445032-72-4445032724
CCOC(=O)C1=C(OC2=C(C1C3=CC=C(O3)COC4=CC(=CC=C4)Br)C(=O)CC(C2)(C)C)N
ethyl2amino4(5((3bromophenoxy)methyl)furan2yl)77dimethyl5oxo5678tetrahydro4Hchromene3carboxylate
ETHYL2AMINO4(5((3BROMOPHENOXY)METHYL)FURAN2YL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBOXYLATE
InChI=1SC25H26BrNO6c143024(29)2221(2017(28)1125(23)1219(20)3323(22)27)189816(3218)13311575614(26)1015h51021H4111327H213H3
MFCD02243704
ZINC000000648638
ZINC000002769567
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