Vitas-M small molecule compound
2-[(5E)-5-(4-ethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(2-hydroxy-5-nitrophenyl)acetamide
Catalog ID
STL035864
SMILES CCOc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)CC(=O)Nc1cc(ccc1O)[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 C20H17N3O6S2 MW 459.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O6S2/c1-2-29-14-6-3-12(4-7-14)9-17-19(26)22(20(30)31-17)11-18(25)21-15-10-13(23(27)28)5-8-16(15)24/h3-10,24H,2,11H2,1H3,(H,21,25)/b17-9+InChIKey
WHMFJOXUWBLLAH-RQZCQDPDSA-NSynonyms
2((5E)5((4ethoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)N(2hydroxy5nitrophenyl)acetamide
2((5E)5(4ethoxybenzylidene)4oxo2thioxo13thiazolidin3yl)N(2hydroxy5nitrophenyl)acetamide
CCOC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CC(=O)NC3=C(C=CC(=C3)(N+)(=O)(O))O
CCOc1ccc(cc1)C=C1SC(=S)N(C1=O)CC(=O)Nc1cc(ccc1O)(N+)(=O)(O)
InChI=1SC20H17N3O6S2c1229146312(4714)91719(26)22(20(30)3117)1118(25)21151013(23(27)28)5816(15)24h31024H211H21H3(H2125)b179+
MFCD18192198
ZINC000027530522
ZINC27530522
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