Vitas-M small molecule compound
(4E)-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(3,4-diethoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Catalog ID
STK582126
SMILES CCOc1cc(ccc1OCC)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/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 C32H28ClN3O7S2 MW 666.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28ClN3O7S2/c1-3-40-22-11-9-18(15-24(22)41-4-2)27-26(28(37)19-10-12-23-25(16-19)43-14-13-42-23)29(38)30(39)36(27)31-34-35-32(45-31)44-17-20-7-5-6-8-21(20)33/h5-12,15-16,27,37H,3-4,13-14,17H2,1-2H3/b28-26+InChIKey
OLFGLYICHWZGNE-BYCLXTJYSA-NSynonyms
620576-28-5(4E)1(5((2chlorobenzyl)sulfanyl)134thiadiazol2yl)5(34diethoxyphenyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)pyrrolidine23dione
(4E)1(5((2CHLOROPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)5(34DIETHOXYPHENYL)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)PYRROLIDINE23DIONE
620576285
CCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2C5=NN=C(S5)SCC6=CC=CC=C6Cl)OCC
CCOc1cc(ccc1OCC)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=O)C1=C(c1ccc2c(c1)OCCO2)O
InChI=1SC32H28ClN3O7S2c13402211918(1524(22)4142)2726(28(37)1910122325(1619)4314134223)29(38)30(39)36(27)31343532(4531)441720756821(20)33h51215162737H34131417H212H3b2826+
MFCD07206714
ZINC000150418219
ZINC000150418228
Check stock
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