Vitas-M small molecule compound
1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-(3,4-diethoxyphenyl)-3-hydroxy-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK906509
SMILES CCOc1cc(ccc1OCC)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 C33H31N3O6S2 MW 629.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31N3O6S2/c1-4-40-25-14-11-21(17-26(25)41-5-2)28-27(29(37)22-12-13-24-23(16-22)15-19(3)42-24)30(38)31(39)36(28)32-34-35-33(44-32)43-18-20-9-7-6-8-10-20/h6-14,16-17,19,28,38H,4-5,15,18H2,1-3H3InChIKey
HMFOROSSGMGAEQ-UHFFFAOYSA-NSynonyms
1(5(benzylsulfanyl)134thiadiazol2yl)5(34diethoxyphenyl)3hydroxy4((2methyl23dihydro1benzofuran5yl)carbonyl)15dihydro2Hpyrrol2one
1(5(benzylthio)134thiadiazol2yl)5(34diethoxyphenyl)3hydroxy4(2methyl23dihydrobenzofuran5carbonyl)1Hpyrrol2(5H)one
MFCD18064994
ZINC000097969858
ZINC000097969861
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