Vitas-M small molecule compound

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

Catalog ID
STK192151
SMILES CCOC(=O)N1CCC(CC1)NC(=O)CN1C(=O)c2c(C1c1c[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 C26H28N4O4 MW 460.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O4/c1-2-34-26(33)29-13-11-17(12-14-29)28-23(31)16-30-24(19-8-3-4-9-20(19)25(30)32)21-15-27-22-10-6-5-7-18(21)22/h3-10,15,17,24,27H,2,11-14,16H2,1H3,(H,28,31)
InChIKey
YFJYSDHFXOLOFE-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCC(CC1)NC(=O)CN1C(=O)c2c(C1c1c(nH)c3c1cccc3)cccc2
CCOC(=O)N1CCC(CC1)NC(=O)CN2C(C3=CC=CC=C3C2=O)C4=CNC5=CC=CC=C54
ETHYL4(((1(1HINDOL3YL)3OXO13DIHYDRO2HISOINDOL2YL)ACETYL)AMINO)PIPERIDINE1CARBOXYLATE
ETHYL4((2(1(1HINDOL3YL)3OXO1HISOINDOL2YL)ACETYL)AMINO)PIPERIDINE1CARBOXYLATE
InChI=1SC26H28N4O4c123426(33)29131117(121429)2823(31)163024(19834920(19)25(30)32)211527221065718(21)22h31015172427H2111416H21H3(H2831)
MFCD08674236
ZINC000012362967
ZINC000012362969

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Available files

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