Vitas-M small molecule compound
1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-5-[3-(prop-2-en-1-yloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK908408
SMILES C=CCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)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 C31H23Cl2N3O6S2 MW 668.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H23Cl2N3O6S2/c1-2-10-40-21-5-3-4-17(13-21)26-25(27(37)18-7-9-23-24(14-18)42-12-11-41-23)28(38)29(39)36(26)30-34-35-31(44-30)43-16-19-6-8-20(32)15-22(19)33/h2-9,13-15,26,38H,1,10-12,16H2InChIKey
GWXTVVNYTLHPRU-UHFFFAOYSA-NSynonyms
1(5((24dichlorobenzyl)sulfanyl)134thiadiazol2yl)4(23dihydro14benzodioxin6ylcarbonyl)3hydroxy5(3(prop2en1yloxy)phenyl)15dihydro2Hpyrrol2one
5(3(allyloxy)phenyl)1(5((24dichlorobenzyl)thio)134thiadiazol2yl)4(23dihydrobenzo(b)(14)dioxine6carbonyl)3hydroxy1Hpyrrol2(5H)one
MFCD06285449
ZINC000097967894
ZINC000097967895
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