Vitas-M small molecule compound

(4E)-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[hydroxy(phenyl)methylidene]-5-(pyridin-3-yl)pyrrolidine-2,3-dione

Catalog ID
STL052461
SMILES O=C1C(=O)/C(=C(\c2ccccc2)/O)/C(N1c1nnc(s1)SCc1ccccc1F)c1cccnc1

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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 C25H17FN4O3S2 MW 504.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17FN4O3S2/c26-18-11-5-4-9-17(18)14-34-25-29-28-24(35-25)30-20(16-10-6-12-27-13-16)19(22(32)23(30)33)21(31)15-7-2-1-3-8-15/h1-13,20,31H,14H2/b21-19+
InChIKey
MARHCTQCOBKAPI-XUTLUUPISA-N
Synonyms
848733-95-9
(4E)1(5((2fluorobenzyl)sulfanyl)134thiadiazol2yl)4(hydroxy(phenyl)methylidene)5(pyridin3yl)pyrrolidine23dione
(4E)1(5((2FLUOROPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)4(HYDROXY(PHENYL)METHYLIDENE)5PYRIDIN3YLPYRROLIDINE23DIONE
848733959
C1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NN=C(S3)SCC4=CC=CC=C4F)C5=CN=CC=C5)O
InChI=1SC25H17FN4O3S2c26181154917(18)143425292824(3525)3020(1610612271316)19(22(32)23(30)33)21(31)157213815h1132031H14H2b2119+
MFCD05725684
O=C1C(=O)C(=C(c2ccccc2)O)C(N1c1nnc(s1)SCc1ccccc1F)c1cccnc1
ZINC000102890492
ZINC000102890493

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Available files

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