Vitas-M small molecule compound
ethyl 1-benzyl-5-[3-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-2-hydroxypropoxy]-2-methyl-1H-indole-3-carboxylate
Catalog ID
STK927755
SMILES CCOC(=O)c1c(C)n(c2c1cc(OCC(Cn1nc(c(c1C)Br)C)O)cc2)Cc1ccccc1
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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 C27H30BrN3O4 MW 540.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30BrN3O4/c1-5-34-27(33)25-18(3)30(14-20-9-7-6-8-10-20)24-12-11-22(13-23(24)25)35-16-21(32)15-31-19(4)26(28)17(2)29-31/h6-13,21,32H,5,14-16H2,1-4H3InChIKey
UKLWLGWHVACXBU-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3C(=C(C(=N3)C)Br)C)O)CC4=CC=CC=C4)C
ethyl1benzyl5(3(4bromo35dimethyl1Hpyrazol1yl)2hydroxypropoxy)2methyl1Hindole3carboxylate
ethyl1benzyl5(3(4bromo35dimethylpyrazol1yl)2hydroxypropoxy)2methylindole3carboxylate
ETHYL5(3(4BROMO35DIMETHYLPYRAZOLYL)2HYDROXYPROPOXY)2METHYL1BENZYLINDOLE3CARBOXYLATE
InChI=1SC27H30BrN3O4c153427(33)2518(3)30(142097681020)24121122(1323(24)25)351621(32)153119(4)26(28)17(2)2931h6132132H51416H214H3
MFCD03130670
ZINC000033353609
ZINC000033353610
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