Vitas-M small molecule compound
2-[(5E)-5-{3-ethoxy-4-[(4-nitrobenzyl)oxy]benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2-methylphenyl)acetamide
Catalog ID
STK114708
SMILES CCOc1cc(ccc1OCc1ccc(cc1)[N+](=O)[O-])/C=C\1/SC(=O)N(C1=O)CC(=O)Nc1ccccc1C
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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(10-13-23(24)38-17-19-8-11-21(12-9-19)31(35)36)15-25-27(33)30(28(34)39-25)16-26(32)29-22-7-5-4-6-18(22)2/h4-15H,3,16-17H2,1-2H3,(H,29,32)/b25-15+InChIKey
AXQJTUVFSRRVIM-MFKUBSTISA-NSynonyms
2((5E)5((3ethoxy4((4nitrophenyl)methoxy)phenyl)methylidene)24dioxo13thiazolidin3yl)N(2methylphenyl)acetamide
2((5E)5(3ETHOXY4((4NITROBENZYL)OXY)BENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)N(2METHYLPHENYL)ACETAMIDE
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC(=O)NC3=CC=CC=C3C)OCC4=CC=C(C=C4)(N+)(=O)(O)
CCOc1cc(ccc1OCc1ccc(cc1)(N+)(=O)(O))C=C1SC(=O)N(C1=O)CC(=O)Nc1ccccc1C
InChI=1SC28H25N3O7Sc1337241420(101323(24)38171981121(12919)31(35)36)152527(33)30(28(34)3925)1626(32)2922754618(22)2h415H31617H212H3(H2932)b2515+
MFCD04277783
ZINC000100343135
ZINC100343135
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