Vitas-M small molecule compound
methyl 5-bromo-3-({[4-(9H-fluoren-9-yl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Catalog ID
STK529713
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1c3ccccc3c3c1cccc3)cc(cc2)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 C29H27BrN4O3 MW 559.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27BrN4O3/c1-37-29(36)27-26(23-16-18(30)10-11-24(23)31-27)32-25(35)17-33-12-14-34(15-13-33)28-21-8-4-2-6-19(21)20-7-3-5-9-22(20)28/h2-11,16,28,31H,12-15,17H2,1H3,(H,32,35)InChIKey
QEOUOYGEZKOPTR-UHFFFAOYSA-NSynonyms
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)C1c3ccccc3c3c1cccc3)cc(cc2)Br
COC(=O)C1=C(C2=C(N1)C=CC(=C2)Br)NC(=O)CN3CCN(CC3)C4C5=CC=CC=C5C6=CC=CC=C46
InChI=1SC29H27BrN4O3c13729(36)2726(231618(30)101124(23)3127)3225(35)1733121434(151333)2821842619(21)20735922(20)28h211162831H121517H21H3(H3235)
methyl3(2(4(9Hfluoren9yl)piperazin1yl)acetamido)5bromo1Hindole2carboxylate
methyl5bromo3(((4(9Hfluoren9yl)piperazin1yl)acetyl)amino)1Hindole2carboxylate
METHYL5BROMO3((2(4(9HFLUOREN9YL)PIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
MFCD01564116
ZINC000102406834
ZINC102406834
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