Vitas-M small molecule compound
(4E)-5-(4-butoxy-3-ethoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Catalog ID
STK590490
SMILES CCCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2cccc3c2cccc3)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 C38H35N3O7S2 MW 709.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H35N3O7S2/c1-3-5-17-46-28-15-13-24(20-30(28)45-4-2)33-32(34(42)25-14-16-29-31(21-25)48-19-18-47-29)35(43)36(44)41(33)37-39-40-38(50-37)49-22-26-11-8-10-23-9-6-7-12-27(23)26/h6-16,20-21,33,42H,3-5,17-19,22H2,1-2H3/b34-32+InChIKey
UDOIESNLNHXRJU-NWBJSICCSA-NSynonyms
618855-77-9(4E)5(4butoxy3ethoxyphenyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(5((naphthalen1ylmethyl)sulfanyl)134thiadiazol2yl)pyrrolidine23dione
(4E)5(4BUTOXY3ETHOXYPHENYL)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(5(NAPHTHALEN1YLMETHYLSULFANYL)134THIADIAZOL2YL)PYRROLIDINE23DIONE
618855779
CCCCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2C5=NN=C(S5)SCC6=CC=CC7=CC=CC=C76)OCC
CCCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)C1=C(c1ccc2c(c1)OCCO2)O
InChI=1SC38H35N3O7S2c135174628151324(2030(28)4542)3332(34(42)2514162931(2125)4819184729)35(43)36(44)41(33)37394038(5037)49222611810239671227(23)26h61620213342H35171922H212H3b3432+
MFCD07212594
ZINC000150481065
ZINC000150481069
Check stock
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Check stock on Vitas-MAvailable files
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