Vitas-M small molecule compound
(5E)-5-(4-methoxy-3-nitrobenzylidene)-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,3-thiazolidine-2,4-dione
Catalog ID
STK152886
SMILES COc1ccc(cc1[N+](=O)[O-])/C=C\1/SC(=O)N(C1=O)CC(=O)N1CCN(CC1)c1ccccc1
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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 C23H22N4O6S MW 482.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O6S/c1-33-19-8-7-16(13-18(19)27(31)32)14-20-22(29)26(23(30)34-20)15-21(28)25-11-9-24(10-12-25)17-5-3-2-4-6-17/h2-8,13-14H,9-12,15H2,1H3/b20-14+InChIKey
WCCWIZBMHSDROM-XSFVSMFZSA-NSynonyms
(5E)5((4METHOXY3NITROPHENYL)METHYLIDENE)3(2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)13THIAZOLIDINE24DIONE
(5E)5(4METHOXY3NITROBENZYLIDENE)3(2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)13THIAZOLIDINE24DIONE
COC1=C(C=C(C=C1)C=C2C(=O)N(C(=O)S2)CC(=O)N3CCN(CC3)C4=CC=CC=C4)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C=C1SC(=O)N(C1=O)CC(=O)N1CCN(CC1)c1ccccc1
InChI=1SC23H22N4O6Sc133198716(1318(19)27(31)32)142022(29)26(23(30)3420)1521(28)2511924(101225)175324617h281314H91215H21H3b2014+
MFCD03714966
ZINC000009310808
ZINC09310808
ZINC9310808
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