Vitas-M small molecule compound
(4E)-5-(4-butoxy-3-ethoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Catalog ID
STK568890
SMILES CCCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)/C/1=C(\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 C39H37N3O6S2 MW 707.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H37N3O6S2/c1-4-6-18-47-31-17-14-25(21-32(31)46-5-2)34-33(35(43)26-15-16-30-28(20-26)19-23(3)48-30)36(44)37(45)42(34)38-40-41-39(50-38)49-22-27-12-9-11-24-10-7-8-13-29(24)27/h7-17,20-21,23,34,43H,4-6,18-19,22H2,1-3H3/b35-33+InChIKey
LXHVFFQYHQIHKY-LAPDZXRHSA-NSynonyms
893695-95-9(4E)5(4butoxy3ethoxyphenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)1(5((naphthalen1ylmethyl)sulfanyl)134thiadiazol2yl)pyrrolidine23dione
(4E)5(4BUTOXY3ETHOXYPHENYL)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)1(5(NAPHTHALEN1YLMETHYLSULFANYL)134THIADIAZOL2YL)PYRROLIDINE23DIONE
893695959
CCCCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)O)C(=O)C(=O)N2C5=NN=C(S5)SCC6=CC=CC7=CC=CC=C76)OCC
CCCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)C1=C(c1ccc2c(c1)CC(O2)C)O
InChI=1SC39H37N3O6S2c146184731171425(2132(31)4652)3433(35(43)2615163028(2026)1923(3)4830)36(44)37(45)42(34)38404139(5038)492227129112410781329(24)27h7172021233443H46181922H213H3b3533+
MFCD05727776
ZINC000150460641
ZINC000150460652
Check stock
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