Vitas-M small molecule compound
5-[4-(benzyloxy)-3-ethoxyphenyl]-1-{5-[(2,4-dichlorobenzyl)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
STK904723
SMILES CCOc1cc(ccc1OCc1ccccc1)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)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 C38H31Cl2N3O6S2 MW 760.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H31Cl2N3O6S2/c1-3-47-31-17-23(10-14-30(31)48-19-22-7-5-4-6-8-22)33-32(34(44)24-11-13-29-26(16-24)15-21(2)49-29)35(45)36(46)43(33)37-41-42-38(51-37)50-20-25-9-12-27(39)18-28(25)40/h4-14,16-18,21,33,45H,3,15,19-20H2,1-2H3InChIKey
DSYRIIJYHPDRLC-UHFFFAOYSA-NSynonyms
5(4(benzyloxy)3ethoxyphenyl)1(5((24dichlorobenzyl)sulfanyl)134thiadiazol2yl)3hydroxy4((2methyl23dihydro1benzofuran5yl)carbonyl)15dihydro2Hpyrrol2one
5(4(benzyloxy)3ethoxyphenyl)1(5((24dichlorobenzyl)thio)134thiadiazol2yl)3hydroxy4(2methyl23dihydrobenzofuran5carbonyl)1Hpyrrol2(5H)one
MFCD18076148
ZINC000097967733
ZINC000097967736
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