Vitas-M small molecule compound
(4E)-1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-[3-ethoxy-4-(pentyloxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STK584185
SMILES CCCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccc(cc1Cl)Cl
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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 C36H35Cl2N3O6S2 MW 740.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H35Cl2N3O6S2/c1-4-6-7-14-46-28-13-9-21(17-29(28)45-5-2)31-30(32(42)22-10-12-27-24(16-22)15-20(3)47-27)33(43)34(44)41(31)35-39-40-36(49-35)48-19-23-8-11-25(37)18-26(23)38/h8-13,16-18,20,31,42H,4-7,14-15,19H2,1-3H3/b32-30+InChIKey
LAOGLNRQSDBICE-NHQGMKOOSA-NSynonyms
897835-60-8(4E)1(5((24dichlorobenzyl)sulfanyl)134thiadiazol2yl)5(3ethoxy4(pentyloxy)phenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)pyrrolidine23dione
(4E)1(5((24dichlorophenyl)methylsulfanyl)134thiadiazol2yl)5(3ethoxy4pentoxyphenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)pyrrolidine23dione
897835608
CCCCCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)O)C(=O)C(=O)N2C5=NN=C(S5)SCC6=C(C=C(C=C6)Cl)Cl)OCC
CCCCCOc1ccc(cc1OCC)C1C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C(=O)N1c1nnc(s1)SCc1ccc(cc1Cl)Cl
InChI=1SC36H35Cl2N3O6S2c146714462813921(1729(28)4552)3130(32(42)2210122724(1622)1520(3)4727)33(43)34(44)41(31)35394036(4935)48192381125(37)1826(23)38h8131618203142H47141519H213H3b3230+
MFCD07212243
ZINC000150475832
ZINC000150475837
Check stock
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