Vitas-M small molecule compound
4-(1-benzofuran-2-ylcarbonyl)-3-hydroxy-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-[4-(prop-2-en-1-yloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK800319
SMILES C=CCOc1ccc(cc1)C1N(c2nnc(s2)SCc2ccc(cc2)C)C(=O)C(=C1C(=O)c1cc2c(o1)cccc2)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 C32H25N3O5S2 MW 595.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H25N3O5S2/c1-3-16-39-23-14-12-21(13-15-23)27-26(28(36)25-17-22-6-4-5-7-24(22)40-25)29(37)30(38)35(27)31-33-34-32(42-31)41-18-20-10-8-19(2)9-11-20/h3-15,17,27,37H,1,16,18H2,2H3InChIKey
QGPYLERAELMBOD-UHFFFAOYSA-NSynonyms
3(1BENZOFURAN2CARBONYL)4HYDROXY1(5((4METHYLPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)2(4PROP2ENOXYPHENYL)2HPYRROL5ONE
4(1benzofuran2ylcarbonyl)3hydroxy1(5((4methylbenzyl)sulfanyl)134thiadiazol2yl)5(4(prop2en1yloxy)phenyl)15dihydro2Hpyrrol2one
5(4(ALLYLOXY)PHENYL)4(1BENZOFURAN2YLCARBONYL)3HYDROXY1(5((4METHYLBENZYL)SULFANYL)134THIADIAZOL2YL)15DIHYDRO2HPYRROL2ONE
CC1=CC=C(C=C1)CSC2=NN=C(S2)N3C(C(=C(C3=O)O)C(=O)C4=CC5=CC=CC=C5O4)C6=CC=C(C=C6)OCC=C
InChI=1SC32H25N3O5S2c13163923141221(131523)2726(28(36)251722645724(22)4025)29(37)30(38)35(27)31333432(4231)41182010819(2)91120h315172737H11618H22H3
MFCD04148021
ZINC000008383994
ZINC000008384001
Check stock
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Check stock on Vitas-MAvailable files
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