Vitas-M small molecule compound
1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-5-[4-(propan-2-yl)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK883706
SMILES O=C1C(=C(C(N1c1nnc(s1)SCc1ccccc1)c1ccc(cc1)C(C)C)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 C31H27N3O5S2 MW 585.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N3O5S2/c1-18(2)20-8-10-21(11-9-20)26-25(27(35)22-12-13-23-24(16-22)39-15-14-38-23)28(36)29(37)34(26)30-32-33-31(41-30)40-17-19-6-4-3-5-7-19/h3-13,16,18,26,36H,14-15,17H2,1-2H3InChIKey
CFUDIWOSKMSBIH-UHFFFAOYSA-NSynonyms
1(5(benzylsulfanyl)134thiadiazol2yl)4(23dihydro14benzodioxin6ylcarbonyl)3hydroxy5(4(propan2yl)phenyl)15dihydro2Hpyrrol2one
1(5(benzylthio)134thiadiazol2yl)4(23dihydrobenzo(b)(14)dioxine6carbonyl)3hydroxy5(4isopropylphenyl)1Hpyrrol2(5H)one
MFCD04027714
ZINC000097968212
ZINC000097968213
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