Vitas-M small molecule compound

2-[(5E)-5-{3-ethoxy-4-[(4-nitrobenzyl)oxy]benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(4-fluorophenyl)acetamide

Catalog ID
STK116243
SMILES CCOc1cc(ccc1OCc1ccc(cc1)[N+](=O)[O-])/C=C\1/SC(=O)N(C1=O)CC(=O)Nc1ccc(cc1)F

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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 C27H22FN3O7S MW 551.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22FN3O7S/c1-2-37-23-13-18(5-12-22(23)38-16-17-3-10-21(11-4-17)31(35)36)14-24-26(33)30(27(34)39-24)15-25(32)29-20-8-6-19(28)7-9-20/h3-14H,2,15-16H2,1H3,(H,29,32)/b24-14+
InChIKey
MPLQMJMHIQJOBQ-ZVHZXABRSA-N
Synonyms

2((5E)5((3ethoxy4((4nitrophenyl)methoxy)phenyl)methylidene)24dioxo13thiazolidin3yl)N(4fluorophenyl)acetamide
2((5E)5(3ETHOXY4((4NITROBENZYL)OXY)BENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)N(4FLUOROPHENYL)ACETAMIDE
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC(=O)NC3=CC=C(C=C3)F)OCC4=CC=C(C=C4)(N+)(=O)(O)
CCOc1cc(ccc1OCc1ccc(cc1)(N+)(=O)(O))C=C1SC(=O)N(C1=O)CC(=O)Nc1ccc(cc1)F
InChI=1SC27H22FN3O7Sc1237231318(51222(23)38161731021(11417)31(35)36)142426(33)30(27(34)3924)1525(32)29208619(28)7920h314H21516H21H3(H2932)b2414+
MFCD04277751
ZINC000100231737
ZINC100231737

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Available files

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