Vitas-M small molecule compound
2-ethoxy-4-{(E)-[2-(4-methylpiperazin-1-ium-1-yl)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}phenolate
Catalog ID
STL149502
SMILES CCOc1cc(ccc1[O-])/C=C\1/SC(=NC1=O)[NH+]1CCN(CC1)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 C17H21N3O3S MW 347.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O3S/c1-3-23-14-10-12(4-5-13(14)21)11-15-16(22)18-17(24-15)20-8-6-19(2)7-9-20/h4-5,10-11,21H,3,6-9H2,1-2H3/b15-11+InChIKey
GRIKLRHBHOZIEH-RVDMUPIBSA-NSynonyms
(5E)5((3ETHOXY4HYDROXYPHENYL)METHYLIDENE)2(4METHYLPIPERAZIN1YL)13THIAZOL4ONE
2ethoxy4((E)(2(4methylpiperazin1ium1yl)4oxo13thiazol5(4H)ylidene)methyl)phenolate
CCOc1cc(ccc1(O))C=C1SC(=NC1=O)(NH+)1CCN(CC1)C
InChI=1SC17H21N3O3Sc1323141012(4513(14)21)111516(22)1817(2415)208619(2)7920h45101121H369H212H3b1511+
MFCD01618522
ZINC000019948532
ZINC19948532
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