Vitas-M small molecule compound
5-[4-(benzyloxy)-3-ethoxyphenyl]-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK908497
SMILES CCOc1cc(ccc1OCc1ccccc1)C1C(=C(C(=O)N1c1nnc(s1)SCc1cccc2c1cccc2)O)C(=O)c1ccc2c(c1)OCCO2
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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 C41H33N3O7S2 MW 743.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C41H33N3O7S2/c1-2-48-33-21-27(15-17-32(33)51-23-25-9-4-3-5-10-25)36-35(37(45)28-16-18-31-34(22-28)50-20-19-49-31)38(46)39(47)44(36)40-42-43-41(53-40)52-24-29-13-8-12-26-11-6-7-14-30(26)29/h3-18,21-22,36,46H,2,19-20,23-24H2,1H3InChIKey
ZSLBLIASEMFZGN-UHFFFAOYSA-NSynonyms
5(4(benzyloxy)3ethoxyphenyl)4(23dihydro14benzodioxin6ylcarbonyl)3hydroxy1(5((naphthalen1ylmethyl)sulfanyl)134thiadiazol2yl)15dihydro2Hpyrrol2one
5(4(benzyloxy)3ethoxyphenyl)4(23dihydrobenzo(b)(14)dioxine6carbonyl)3hydroxy1(5((naphthalen1ylmethyl)thio)134thiadiazol2yl)1Hpyrrol2(5H)one
MFCD04573866
ZINC000097968007
ZINC000097968008
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