Vitas-M small molecule compound
(5Z)-5-{[3-(4-ethoxy-3-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK812797
SMILES C=CCN1C(=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 C24H20FN3O2S2 MW 465.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20FN3O2S2/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/h3,5-11,13-15H,1,4,12H2,2H3/b21-14-InChIKey
QQNRWQLARNJBSK-STZFKDTASA-NSynonyms
(5Z)5((3(4ethoxy3fluorophenyl)1phenyl1Hpyrazol4yl)methylidene)3(prop2en1yl)2thioxo13thiazolidin4one
(5Z)5((3(4ETHOXY3FLUOROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
C=CCN1C(=S)SC(=Cc2cn(nc2c2ccc(c(c2)F)OCC)c2ccccc2)C1=O
CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC=C)C4=CC=CC=C4)F
InChI=1SC24H20FN3O2S2c13122723(29)21(3224(27)31)14171528(188657918)2622(17)16101120(3042)19(25)1316h35111315H1412H22H3b2114
MFCD03506496
ZINC000016729197
ZINC16729197
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