Vitas-M small molecule compound
(5Z)-3-ethyl-5-[(3-{3-[(4-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK706824
SMILES CCN1C(=S)S/C(=C\c2cn(nc2c2cccc(c2)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 C28H22FN3O2S2 MW 515.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22FN3O2S2/c1-2-31-27(33)25(36-28(31)35)16-21-17-32(23-8-4-3-5-9-23)30-26(21)20-7-6-10-24(15-20)34-18-19-11-13-22(29)14-12-19/h3-17H,2,18H2,1H3/b25-16-InChIKey
QRJPOETZQHUWCI-XYGWBWBKSA-NSynonyms
1009438-09-8(5Z)3ethyl5((3(3((4fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3ETHYL5((3(3((4FLUOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3ethyl5((3(3((4fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin4one
1009438098
CCN1C(=O)C(=CC2=CN(N=C2C3=CC(=CC=C3)OCC4=CC=C(C=C4)F)C5=CC=CC=C5)SC1=S
CCN1C(=S)SC(=Cc2cn(nc2c2cccc(c2)OCc2ccc(cc2)F)c2ccccc2)C1=O
InChI=1SC28H22FN3O2S2c123127(33)25(3628(31)35)16211732(238435923)3026(21)20761024(1520)341819111322(29)141219h317H218H21H3b2516
MFCD04022803
ZINC000002361966
ZINC02361966
ZINC2361966
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