Vitas-M small molecule compound
ethyl 4-{3-[(5E)-5-(2-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}piperazine-1-carboxylate
Catalog ID
STL035908
SMILES CCOC(=O)N1CCN(CC1)C(=O)CCN1C(=S)S/C(=C/c2ccccc2F)/C1=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 C20H22FN3O4S2 MW 451.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22FN3O4S2/c1-2-28-19(27)23-11-9-22(10-12-23)17(25)7-8-24-18(26)16(30-20(24)29)13-14-5-3-4-6-15(14)21/h3-6,13H,2,7-12H2,1H3/b16-13+InChIKey
PTJDZNJNYJDEGT-DTQAZKPQSA-NSynonyms
477488-44-1477488441
CCOC(=O)N1CCN(CC1)C(=O)CCN1C(=S)SC(=Cc2ccccc2F)C1=O
CCOC(=O)N1CCN(CC1)C(=O)CCN2C(=O)C(=CC3=CC=CC=C3F)SC2=S
ETHYL4(3((5E)5((2FLUOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOYL)PIPERAZINE1CARBOXYLATE
ethyl4(3((5E)5(2fluorobenzylidene)4oxo2thioxo13thiazolidin3yl)propanoyl)piperazine1carboxylate
ETHYL4(3(5((2FLUOROPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)PROPANOYL)PIPERAZINECARBOXYLATE
InChI=1SC20H22FN3O4S2c122819(27)2311922(101223)17(25)782418(26)16(3020(24)29)1314534615(14)21h3613H2712H21H3b1613+
MFCD06742943
ZINC000008819251
ZINC08819251
ZINC8819251
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