Vitas-M small molecule compound

1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-(3-ethoxy-4-propoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one

Catalog ID
STK908306
SMILES CCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=C1C(=O)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 C33H30ClN3O7S2 MW 680.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30ClN3O7S2/c1-3-13-42-23-11-9-19(16-25(23)41-4-2)28-27(29(38)20-10-12-24-26(17-20)44-15-14-43-24)30(39)31(40)37(28)32-35-36-33(46-32)45-18-21-7-5-6-8-22(21)34/h5-12,16-17,28,39H,3-4,13-15,18H2,1-2H3
InChIKey
XYEGYXVKEGNKHV-UHFFFAOYSA-N
Synonyms

1(5((2chlorobenzyl)sulfanyl)134thiadiazol2yl)4(23dihydro14benzodioxin6ylcarbonyl)5(3ethoxy4propoxyphenyl)3hydroxy15dihydro2Hpyrrol2one
1(5((2chlorobenzyl)thio)134thiadiazol2yl)4(23dihydrobenzo(b)(14)dioxine6carbonyl)5(3ethoxy4propoxyphenyl)3hydroxy1Hpyrrol2(5H)one
MFCD04543532
ZINC000097968130
ZINC000097968131

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Available files

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