Vitas-M small molecule compound
2-[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]-1-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}ethanone
Catalog ID
STL410909
SMILES O=C(N1CCN(CC1)C/C=C/c1ccccc1)COc1ccc(cc1)c1nnn(n1)C
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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 C23H26N6O2 MW 418.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N6O2/c1-27-25-23(24-26-27)20-9-11-21(12-10-20)31-18-22(30)29-16-14-28(15-17-29)13-5-8-19-6-3-2-4-7-19/h2-12H,13-18H2,1H3/b8-5+InChIKey
YQEVEHWTFRDMKI-VMPITWQZSA-NSynonyms
1574537-60-2(E)1(4cinnamylpiperazin1yl)2(4(2methyl2Htetrazol5yl)phenoxy)ethanone
1574537602
2(4(2methyl2Htetrazol5yl)phenoxy)1(4((2E)3phenylprop2en1yl)piperazin1yl)ethanone
2(4(2methyltetrazol5yl)phenoxy)1(4((E)3phenylprop2enyl)piperazin1yl)ethanone
CN1N=C(N=N1)C2=CC=C(C=C2)OCC(=O)N3CCN(CC3)CC=CC4=CC=CC=C4
InChI=1SC23H26N6O2c1272523(242627)2091121(121020)311822(30)29161428(151729)1358196324719h212H1318H21H3b85+
MFCD28058399
O=C(N1CCN(CC1)CC=Cc1ccccc1)COc1ccc(cc1)c1nnn(n1)C
ZINC000096230832
ZINC96230832
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