Vitas-M small molecule compound
1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-(2-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK907886
SMILES O=C1C(=C(C(N1c1nnc(s1)SCc1ccccc1)c1ccccc1F)C(=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 C28H20FN3O5S2 MW 561.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20FN3O5S2/c29-19-9-5-4-8-18(19)23-22(24(33)17-10-11-20-21(14-17)37-13-12-36-20)25(34)26(35)32(23)27-30-31-28(39-27)38-15-16-6-2-1-3-7-16/h1-11,14,23,34H,12-13,15H2InChIKey
MUKSVNQJAXTHKC-UHFFFAOYSA-NSynonyms
1(5(benzylsulfanyl)134thiadiazol2yl)4(23dihydro14benzodioxin6ylcarbonyl)5(2fluorophenyl)3hydroxy15dihydro2Hpyrrol2one
1(5(benzylthio)134thiadiazol2yl)4(23dihydrobenzo(b)(14)dioxine6carbonyl)5(2fluorophenyl)3hydroxy1Hpyrrol2(5H)one
MFCD04026490
ZINC000097967911
ZINC000097967912
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