Vitas-M small molecule compound
2-(2-ethoxy-4-{(E)-[3-(4-nitrobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)-N-(3-methylphenyl)acetamide
Catalog ID
STL358167
SMILES CCOc1cc(ccc1OCC(=O)Nc1cccc(c1)C)/C=C\1/SC(=O)N(C1=O)Cc1ccc(cc1)[N+](=O)[O-]
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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 C28H25N3O7S MW 547.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O7S/c1-3-37-24-14-20(9-12-23(24)38-17-26(32)29-21-6-4-5-18(2)13-21)15-25-27(33)30(28(34)39-25)16-19-7-10-22(11-8-19)31(35)36/h4-15H,3,16-17H2,1-2H3,(H,29,32)/b25-15+InChIKey
KFAAICBEGNAJOL-MFKUBSTISA-NSynonyms
2(2ethoxy4((E)(3((4nitrophenyl)methyl)24dioxo13thiazolidin5ylidene)methyl)phenoxy)N(3methylphenyl)acetamide
2(2ethoxy4((E)(3(4nitrobenzyl)24dioxo13thiazolidin5ylidene)methyl)phenoxy)N(3methylphenyl)acetamide
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=C(C=C3)(N+)(=O)(O))OCC(=O)NC4=CC=CC(=C4)C
CCOc1cc(ccc1OCC(=O)Nc1cccc(c1)C)C=C1SC(=O)N(C1=O)Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC28H25N3O7Sc1337241420(91223(24)381726(32)292164518(2)1321)152527(33)30(28(34)3925)161971022(11819)31(35)36h415H31617H212H3(H2932)b2515+
MFCD04085673
ZINC000100359333
ZINC100359333
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