Vitas-M small molecule compound
ethyl 1-benzyl-2-{[4-(ethoxycarbonyl)-4-phenylpiperidin-1-yl]methyl}-5-hydroxy-1H-indole-3-carboxylate
Catalog ID
STK688428
SMILES CCOC(=O)c1c2cc(O)ccc2n(c1CN1CCC(CC1)(C(=O)OCC)c1ccccc1)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 C33H36N2O5 MW 540.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H36N2O5/c1-3-39-31(37)30-27-21-26(36)15-16-28(27)35(22-24-11-7-5-8-12-24)29(30)23-34-19-17-33(18-20-34,32(38)40-4-2)25-13-9-6-10-14-25/h5-16,21,36H,3-4,17-20,22-23H2,1-2H3InChIKey
WDDMBQYQJYJZCL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)CC3=CC=CC=C3)CN4CCC(CC4)(C5=CC=CC=C5)C(=O)OCC
ethyl1benzyl2((4(ethoxycarbonyl)4phenylpiperidin1yl)methyl)5hydroxy1Hindole3carboxylate
ETHYL1BENZYL2((4ETHOXYCARBONYL4PHENYLPIPERIDIN1YL)METHYL)5HYDROXYINDOLE3CARBOXYLATE
InChI=1SC33H36N2O5c133931(37)30272126(36)151628(27)35(2224117581224)29(30)2334191733(18203432(38)4042)251396101425h5162136H3417202223H212H3
MFCD07657574
ZINC000100215500
ZINC100215500
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