Vitas-M small molecule compound

4-(1-benzofuran-2-ylcarbonyl)-5-(3-ethoxy-4-hydroxyphenyl)-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one

Catalog ID
STK799577
SMILES CCOc1cc(ccc1O)C1N(c2nnc(s2)SCc2ccccc2F)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 C30H22FN3O6S2 MW 603.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22FN3O6S2/c1-2-39-22-14-17(11-12-20(22)35)25-24(26(36)23-13-16-7-4-6-10-21(16)40-23)27(37)28(38)34(25)29-32-33-30(42-29)41-15-18-8-3-5-9-19(18)31/h3-14,25,35,37H,2,15H2,1H3
InChIKey
LFQNVNJPIDUGLU-UHFFFAOYSA-N
Synonyms

3(1BENZOFURAN2CARBONYL)2(3ETHOXY4HYDROXYPHENYL)1(5((2FLUOROPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)4HYDROXY2HPYRROL5ONE
4(1benzofuran2ylcarbonyl)5(3ethoxy4hydroxyphenyl)1(5((2fluorobenzyl)sulfanyl)134thiadiazol2yl)3hydroxy15dihydro2Hpyrrol2one
CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=CC=CC=C4F)O)C(=O)C5=CC6=CC=CC=C6O5)O
InChI=1SC30H22FN3O6S2c1239221417(111220(22)35)2524(26(36)2313167461021(16)4023)27(37)28(38)34(25)29323330(4229)411518835919(18)31h314253537H215H21H3
MFCD04088629
ZINC000008383464
ZINC000008383466

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Available files

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