Vitas-M small molecule compound
5-[3-ethoxy-4-(pentyloxy)phenyl]-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK904763
SMILES CCCCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccccc2F)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 C36H36FN3O6S2 MW 689.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H36FN3O6S2/c1-4-6-9-16-45-28-15-12-22(19-29(28)44-5-2)31-30(32(41)23-13-14-27-25(18-23)17-21(3)46-27)33(42)34(43)40(31)35-38-39-36(48-35)47-20-24-10-7-8-11-26(24)37/h7-8,10-15,18-19,21,31,42H,4-6,9,16-17,20H2,1-3H3InChIKey
UQNYJGMXKNFWLD-UHFFFAOYSA-NSynonyms
5(3ethoxy4(pentyloxy)phenyl)1(5((2fluorobenzyl)sulfanyl)134thiadiazol2yl)3hydroxy4((2methyl23dihydro1benzofuran5yl)carbonyl)15dihydro2Hpyrrol2one
5(3ethoxy4(pentyloxy)phenyl)1(5((2fluorobenzyl)thio)134thiadiazol2yl)3hydroxy4(2methyl23dihydrobenzofuran5carbonyl)1Hpyrrol2(5H)one
MFCD18076157
ZINC000097970196
ZINC000097970199
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