Vitas-M small molecule compound

2-chloro-N-[(1Z)-1-(furan-2-yl)-3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-2-yl]benzamide

Catalog ID
STK773037
SMILES O=C(/C(=C/c1ccco1)/NC(=O)c1ccccc1Cl)NCCc1c(C)[nH]c2c1cccc2

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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 C25H22ClN3O3 MW 447.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O3/c1-16-18(19-8-3-5-11-22(19)28-16)12-13-27-25(31)23(15-17-7-6-14-32-17)29-24(30)20-9-2-4-10-21(20)26/h2-11,14-15,28H,12-13H2,1H3,(H,27,31)(H,29,30)/b23-15-
InChIKey
UHAYLHHTWCQXHX-HAHDFKILSA-N
Synonyms

2chloroN((1Z)1(furan2yl)3((2(2methyl1Hindol3yl)ethyl)amino)3oxoprop1en2yl)benzamide
2CHLORON((Z)1(FURAN2YL)3(2(2METHYL1HINDOL3YL)ETHYLAMINO)3OXOPROP1EN2YL)BENZAMIDE
CC1=C(C2=CC=CC=C2N1)CCNC(=O)C(=CC3=CC=CO3)NC(=O)C4=CC=CC=C4Cl
InChI=1SC25H22ClN3O3c11618(198351122(19)2816)12132725(31)23(151776143217)2924(30)209241021(20)26h211141528H1213H21H3(H2731)(H2930)b2315
MFCD03821167
O=C(C(=Cc1ccco1)NC(=O)c1ccccc1Cl)NCCc1c(C)(nH)c2c1cccc2
ZINC000003626685
ZINC03626685
ZINC3626685

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Available files

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