Vitas-M small molecule compound

ethyl 4-({[1-(2-methyl-1H-indol-3-yl)-3-oxo-1,3-dihydro-2H-isoindol-2-yl]acetyl}amino)piperidine-1-carboxylate

Catalog ID
STK192162
SMILES CCOC(=O)N1CCC(CC1)NC(=O)CN1C(=O)c2c(C1c1c(C)[nH]c3c1cccc3)cccc2

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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 C27H30N4O4 MW 474.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O4/c1-3-35-27(34)30-14-12-18(13-15-30)29-23(32)16-31-25(19-8-4-5-9-20(19)26(31)33)24-17(2)28-22-11-7-6-10-21(22)24/h4-11,18,25,28H,3,12-16H2,1-2H3,(H,29,32)
InChIKey
BXWBDXXFOFUHER-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCC(CC1)NC(=O)CN1C(=O)c2c(C1c1c(C)(nH)c3c1cccc3)cccc2
CCOC(=O)N1CCC(CC1)NC(=O)CN2C(C3=CC=CC=C3C2=O)C4=C(NC5=CC=CC=C54)C
ETHYL4(((1(2METHYL1HINDOL3YL)3OXO13DIHYDRO2HISOINDOL2YL)ACETYL)AMINO)PIPERIDINE1CARBOXYLATE
ethyl4((2(1(2methyl1Hindol3yl)3oxo1Hisoindol2yl)acetyl)amino)piperidine1carboxylate
InChI=1SC27H30N4O4c133527(34)30141218(131530)2923(32)163125(19845920(19)26(31)33)2417(2)282211761021(22)24h411182528H31216H212H3(H2932)
MFCD08674317
ZINC000009933329
ZINC000009933330

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.