Vitas-M small molecule compound
(5Z)-5-{[3-(4-ethoxy-3-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-propyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK812784
SMILES CCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(c(c2)F)OCC)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 C24H22FN3O2S2 MW 467.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22FN3O2S2/c1-3-12-27-23(29)21(32-24(27)31)14-17-15-28(18-8-6-5-7-9-18)26-22(17)16-10-11-20(30-4-2)19(25)13-16/h5-11,13-15H,3-4,12H2,1-2H3/b21-14-InChIKey
UHHRHZZVBRRSKL-STZFKDTASA-NSynonyms
(5Z)5((3(4ethoxy3fluorophenyl)1phenyl1Hpyrazol4yl)methylidene)3propyl2thioxo13thiazolidin4one
(5Z)5((3(4ethoxy3fluorophenyl)1phenylpyrazol4yl)methylidene)3propyl2sulfanylidene13thiazolidin4one
CCCN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OCC)F)C4=CC=CC=C4)SC1=S
CCCN1C(=S)SC(=Cc2cn(nc2c2ccc(c(c2)F)OCC)c2ccccc2)C1=O
InChI=1SC24H22FN3O2S2c13122723(29)21(3224(27)31)14171528(188657918)2622(17)16101120(3042)19(25)1316h5111315H3412H212H3b2114
MFCD03506456
ZINC000016729169
ZINC16729169
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