Vitas-M small molecule compound
(5Z)-5-[(3-{4-[(2-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-3-(propan-2-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK797917
SMILES CC(N1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2)OCc2ccccc2F)c2ccccc2)/C1=O)C
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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/c1-19(2)33-28(34)26(37-29(33)36)16-22-17-32(23-9-4-3-5-10-23)31-27(22)20-12-14-24(15-13-20)35-18-21-8-6-7-11-25(21)30/h3-17,19H,18H2,1-2H3/b26-16-InChIKey
NYLSANIRZDJPJU-QQXSKIMKSA-NSynonyms
(5Z)5((3(4((2fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(propan2yl)2thioxo13thiazolidin4one
(5Z)5((3(4((2fluorophenyl)methoxy)phenyl)1phenylpyrazol4yl)methylidene)3propan2yl2sulfanylidene13thiazolidin4one
CC(C)N1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=CC=C4F)C5=CC=CC=C5)SC1=S
CC(N1C(=S)SC(=Cc2cn(nc2c2ccc(cc2)OCc2ccccc2F)c2ccccc2)C1=O)C
InChI=1SC29H24FN3O2S2c119(2)3328(34)26(3729(33)36)16221732(2394351023)3127(22)20121424(151320)3518218671125(21)30h31719H18H212H3b2616
MFCD03417289
ZINC000002704636
ZINC2704636
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