Vitas-M small molecule compound
1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-(3-butoxyphenyl)-3-hydroxy-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK904767
SMILES CCCCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccccc2)C(=O)C(=C1C(=O)c1ccc2c(c1)CC(O2)C)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 C33H31N3O5S2 MW 613.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31N3O5S2/c1-3-4-15-40-25-12-8-11-22(18-25)28-27(29(37)23-13-14-26-24(17-23)16-20(2)41-26)30(38)31(39)36(28)32-34-35-33(43-32)42-19-21-9-6-5-7-10-21/h5-14,17-18,20,28,38H,3-4,15-16,19H2,1-2H3InChIKey
WUUBQBIYFDFACY-UHFFFAOYSA-NSynonyms
1(5(benzylsulfanyl)134thiadiazol2yl)5(3butoxyphenyl)3hydroxy4((2methyl23dihydro1benzofuran5yl)carbonyl)15dihydro2Hpyrrol2one
1(5(benzylthio)134thiadiazol2yl)5(3butoxyphenyl)3hydroxy4(2methyl23dihydrobenzofuran5carbonyl)1Hpyrrol2(5H)one
MFCD18065228
ZINC000097969293
ZINC000097969296
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