Vitas-M small molecule compound
ethyl 6-bromo-2-{[4-(ethoxycarbonyl)-4-phenylpiperidin-1-yl]methyl}-5-hydroxy-1-phenyl-1H-indole-3-carboxylate
Catalog ID
STK675568
SMILES CCOC(=O)c1c2cc(O)c(cc2n(c1CN1CCC(CC1)(C(=O)OCC)c1ccccc1)c1ccccc1)Br
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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 C32H33BrN2O5 MW 605.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33BrN2O5/c1-3-39-30(37)29-24-19-28(36)25(33)20-26(24)35(23-13-9-6-10-14-23)27(29)21-34-17-15-32(16-18-34,31(38)40-4-2)22-11-7-5-8-12-22/h5-14,19-20,36H,3-4,15-18,21H2,1-2H3InChIKey
PSWRSAHUNDFIJM-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)Br)C3=CC=CC=C3)CN4CCC(CC4)(C5=CC=CC=C5)C(=O)OCC
ethyl6bromo2((4(ethoxycarbonyl)4phenylpiperidin1yl)methyl)5hydroxy1phenyl1Hindole3carboxylate
ETHYL6BROMO2((4ETHOXYCARBONYL4PHENYLPIPERIDIN1YL)METHYL)5HYDROXY1PHENYLINDOLE3CARBOXYLATE
InChI=1SC32H33BrN2O5c133930(37)29241928(36)25(33)2026(24)35(231396101423)27(29)2134171532(16183431(38)4042)22117581222h514192036H34151821H212H3
MFCD01819425
ZINC000005225922
ZINC5225922
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