Vitas-M small molecule compound
4-{2-[(E)-{2,4-dioxo-3-[2-oxo-2-(4-phenylpiperazin-4-ium-1-yl)ethyl]-1,3-thiazolidin-5-ylidene}methyl]-1H-pyrrol-1-yl}phenolate
Catalog ID
STL041158
SMILES [O-]c1ccc(cc1)n1cccc1/C=C\1/SC(=O)N(C1=O)CC(=O)N1CC[NH+](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 C26H24N4O4S MW 488.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4O4S/c31-22-10-8-20(9-11-22)29-12-4-7-21(29)17-23-25(33)30(26(34)35-23)18-24(32)28-15-13-27(14-16-28)19-5-2-1-3-6-19/h1-12,17,31H,13-16,18H2/b23-17+InChIKey
JURNOCKXEPFJIY-HAVVHWLPSA-NSynonyms
662155-05-7(5E)5((1(4HYDROXYPHENYL)PYRROL2YL)METHYLIDENE)3(2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)13THIAZOLIDINE24DIONE
(O)c1ccc(cc1)n1cccc1C=C1SC(=O)N(C1=O)CC(=O)N1CC(NH+)(CC1)c1ccccc1
4(2((E)(24dioxo3(2oxo2(4phenylpiperazin4ium1yl)ethyl)13thiazolidin5ylidene)methyl)1Hpyrrol1yl)phenolate
4(2((E)(24DIOXO3(2OXO2(4PHENYLPIPERAZIN4IUM1YL)ETHYL)13THIAZOLIDIN5YLIDENE)METHYL)PYRROL1YL)PHENOLATE
662155057
InChI=1SC26H24N4O4Sc312210820(91122)29124721(29)172325(33)30(26(34)3523)1824(32)28151327(141628)195213619h1121731H131618H2b2317+
MFCD03696782
ZINC000013511045
ZINC13511045
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