Vitas-M small molecule compound
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Catalog ID
STK582397
SMILES C=CCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2)C)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 C34H31N3O7S2 MW 657.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H31N3O7S2/c1-4-14-42-24-12-10-22(17-26(24)41-5-2)29-28(30(38)23-11-13-25-27(18-23)44-16-15-43-25)31(39)32(40)37(29)33-35-36-34(46-33)45-19-21-8-6-20(3)7-9-21/h4,6-13,17-18,29,38H,1,5,14-16,19H2,2-3H3/b30-28+InChIKey
VANUDINXPKNXCS-SJCQXOIGSA-NSynonyms
620575-24-8(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)5(3ethoxy4(prop2en1yloxy)phenyl)1(5((4methylbenzyl)sulfanyl)134thiadiazol2yl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)5(3ETHOXY4PROP2ENOXYPHENYL)1(5((4METHYLPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)PYRROLIDINE23DIONE
620575248
C=CCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2)C)C(=O)C(=O)C1=C(c1ccc2c(c1)OCCO2)O
CCOC1=C(C=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2C5=NN=C(S5)SCC6=CC=C(C=C6)C)OCC=C
InChI=1SC34H31N3O7S2c14144224121022(1726(24)4152)2928(30(38)2311132527(1823)4416154325)31(39)32(40)37(29)33353634(4633)4519218620(3)7921h461317182938H15141619H223H3b3028+
MFCD07211749
ZINC000150475146
ZINC000150475148
Check stock
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