Vitas-M small molecule compound
ethyl 1-benzyl-6-bromo-4-{[4-(ethoxycarbonyl)-4-phenylpiperidin-1-yl]methyl}-5-hydroxy-2-methyl-1H-indole-3-carboxylate
Catalog ID
STK689502
SMILES CCOC(=O)c1c2c(CN3CCC(CC3)(C(=O)OCC)c3ccccc3)c(O)c(cc2n(c1C)Cc1ccccc1)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 C34H37BrN2O5 MW 633.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H37BrN2O5/c1-4-41-32(39)29-23(3)37(21-24-12-8-6-9-13-24)28-20-27(35)31(38)26(30(28)29)22-36-18-16-34(17-19-36,33(40)42-5-2)25-14-10-7-11-15-25/h6-15,20,38H,4-5,16-19,21-22H2,1-3H3InChIKey
PYVFVBNCBOALLV-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN3CCC(CC3)(C4=CC=CC=C4)C(=O)OCC)O)Br)CC5=CC=CC=C5)C
ETHYL1BENZYL6BROMO4((4(ETHOXYCARBONYL)4PHENYLPIPERIDIN1YL)METHYL)5HYDROXY2METHYL1HINDOLE3CARBOXYLATE
ethyl1benzyl6bromo4((4ethoxycarbonyl4phenylpiperidin1yl)methyl)5hydroxy2methylindole3carboxylate
InChI=1SC34H37BrN2O5c144132(39)2923(3)37(2124128691324)282027(35)31(38)26(30(28)29)2236181634(17193633(40)4252)2514107111525h6152038H4516192122H213H3
MFCD08532105
ZINC000100223532
ZINC100223532
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