Vitas-M small molecule compound

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

Catalog ID
STK817692
SMILES Fc1ccc(cc1)CSc1nnc(s1)N1C(c2cccc(c2)Oc2ccccc2)C(=C(C1=O)O)C(=O)c1cc2c(o1)cccc2

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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 C34H22FN3O5S2 MW 635.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H22FN3O5S2/c35-23-15-13-20(14-16-23)19-44-34-37-36-33(45-34)38-29(22-8-6-11-25(17-22)42-24-9-2-1-3-10-24)28(31(40)32(38)41)30(39)27-18-21-7-4-5-12-26(21)43-27/h1-18,29,40H,19H2
InChIKey
IPBPZHSEKPYXRD-UHFFFAOYSA-N
Synonyms

3(1BENZOFURAN2CARBONYL)1(5((4FLUOROPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)4HYDROXY2(3PHENOXYPHENYL)2HPYRROL5ONE
4(1benzofuran2ylcarbonyl)1(5((4fluorobenzyl)sulfanyl)134thiadiazol2yl)3hydroxy5(3phenoxyphenyl)15dihydro2Hpyrrol2one
C1=CC=C(C=C1)OC2=CC=CC(=C2)C3C(=C(C(=O)N3C4=NN=C(S4)SCC5=CC=C(C=C5)F)O)C(=O)C6=CC7=CC=CC=C7O6
InChI=1SC34H22FN3O5S2c3523151320(141623)194434373633(4534)3829(22861125(1722)422492131024)28(31(40)32(38)41)30(39)2718217451226(21)4327h1182940H19H2
MFCD04147991
ZINC000008383331
ZINC000008383334

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Available files

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