Vitas-M small molecule compound
5-[3-(benzyloxy)phenyl]-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
STK908506
SMILES O=C(C1=C(O)C(=O)N(C1c1cccc(c1)OCc1ccccc1)c1nnc(s1)SCc1cccc2c1cccc2)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 C39H29N3O6S2 MW 699.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H29N3O6S2/c43-35(27-16-17-31-32(21-27)47-19-18-46-31)33-34(26-12-7-14-29(20-26)48-22-24-8-2-1-3-9-24)42(37(45)36(33)44)38-40-41-39(50-38)49-23-28-13-6-11-25-10-4-5-15-30(25)28/h1-17,20-21,34,44H,18-19,22-23H2InChIKey
XZKKJLVXNREWMC-UHFFFAOYSA-NSynonyms
5(3(benzyloxy)phenyl)4(23dihydro14benzodioxin6ylcarbonyl)3hydroxy1(5((naphthalen1ylmethyl)sulfanyl)134thiadiazol2yl)15dihydro2Hpyrrol2one
5(3(benzyloxy)phenyl)4(23dihydrobenzo(b)(14)dioxine6carbonyl)3hydroxy1(5((naphthalen1ylmethyl)thio)134thiadiazol2yl)1Hpyrrol2(5H)one
MFCD06285453
ZINC000097967930
ZINC000097967931
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