Vitas-M small molecule compound

5-{4-[(2-fluorophenyl)carbonyl]piperazin-1-yl}-2-[(E)-2-(4-methoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile

Catalog ID
STK874655
SMILES N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccccc1F)/C=C/c1ccc(cc1)OC

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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 C24H21FN4O3 MW 432.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21FN4O3/c1-31-18-9-6-17(7-10-18)8-11-22-27-21(16-26)24(32-22)29-14-12-28(13-15-29)23(30)19-4-2-3-5-20(19)25/h2-11H,12-15H2,1H3/b11-8+
InChIKey
XCABUEYQVZGKGW-DHZHZOJOSA-N
Synonyms
940988-52-3
2((1E)2(4METHOXYPHENYL)VINYL)5(4((2FLUOROPHENYL)CARBONYL)PIPERAZINYL)13OXAZOLE4CARBONITRILE
5(4((2fluorophenyl)carbonyl)piperazin1yl)2((E)2(4methoxyphenyl)ethenyl)13oxazole4carbonitrile
5(4(2fluorobenzoyl)piperazin1yl)2((E)2(4methoxyphenyl)ethenyl)13oxazole4carbonitrile
940988523
COC1=CC=C(C=C1)C=CC2=NC(=C(O2)N3CCN(CC3)C(=O)C4=CC=CC=C4F)C#N
InChI=1SC24H21FN4O3c131189617(71018)811222721(1626)24(3222)29141228(131529)23(30)19423520(19)25h211H1215H21H3b118+
MFCD09250302
N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccccc1F)C=Cc1ccc(cc1)OC
ZINC000012418707
ZINC12418707

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Available files

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