Vitas-M small molecule compound
(5Z)-5-[(3-{4-[(4-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-3-propyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK810599
SMILES CCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2)OCc2ccc(cc2)F)c2ccccc2)/C1=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 C29H24FN3O2S2 MW 529.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24FN3O2S2/c1-2-16-32-28(34)26(37-29(32)36)17-22-18-33(24-6-4-3-5-7-24)31-27(22)21-10-14-25(15-11-21)35-19-20-8-12-23(30)13-9-20/h3-15,17-18H,2,16,19H2,1H3/b26-17-InChIKey
IPEHLNUAXLHGJE-ONUIUJJFSA-NSynonyms
(5Z)5((3(4((4fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3propyl2thioxo13thiazolidin4one
(5Z)5((3(4((4FLUOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PROPYL2SULFANYLIDENE13THIAZOLIDIN4ONE
CCCN1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=C(C=C4)F)C5=CC=CC=C5)SC1=S
CCCN1C(=S)SC(=Cc2cn(nc2c2ccc(cc2)OCc2ccc(cc2)F)c2ccccc2)C1=O
InChI=1SC29H24FN3O2S2c12163228(34)26(3729(32)36)17221833(246435724)3127(22)21101425(151121)35192081223(30)13920h3151718H21619H21H3b2617
MFCD03932981
ZINC000002520487
ZINC2520487
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