Vitas-M small molecule compound
(5Z)-5-[(3-{4-[(2-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK823709
SMILES S=C1S/C(=C\c2cn(nc2c2ccc(cc2)OCc2ccccc2F)c2ccccc2)/C(=O)N1CCc1ccccc1
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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 C34H26FN3O2S2 MW 591.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H26FN3O2S2/c35-30-14-8-7-11-26(30)23-40-29-17-15-25(16-18-29)32-27(22-38(36-32)28-12-5-2-6-13-28)21-31-33(39)37(34(41)42-31)20-19-24-9-3-1-4-10-24/h1-18,21-22H,19-20,23H2/b31-21-InChIKey
AGLRRKGVSZAJQR-YQYKVWLJSA-NSynonyms
(5Z)5((3(4((2fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(2phenylethyl)2thioxo13thiazolidin4one
(5Z)5((3(4((2fluorophenyl)methoxy)phenyl)1phenylpyrazol4yl)methylidene)3(2phenylethyl)2sulfanylidene13thiazolidin4one
C1=CC=C(C=C1)CCN2C(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)OCC5=CC=CC=C5F)C6=CC=CC=C6)SC2=S
InChI=1SC34H26FN3O2S2c353014871126(30)234029171525(161829)3227(2238(3632)28125261328)213133(39)37(34(41)4231)20192493141024h1182122H192023H2b3121
MFCD03464213
S=C1SC(=Cc2cn(nc2c2ccc(cc2)OCc2ccccc2F)c2ccccc2)C(=O)N1CCc1ccccc1
ZINC000097947184
ZINC97947184
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