Vitas-M small molecule compound
(5Z)-5-{[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK822935
SMILES C=CCN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2)Br)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 C22H16BrN3OS2 MW 482.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16BrN3OS2/c1-2-12-25-21(27)19(29-22(25)28)13-16-14-26(18-6-4-3-5-7-18)24-20(16)15-8-10-17(23)11-9-15/h2-11,13-14H,1,12H2/b19-13-InChIKey
CJRVBOAKLZUGNC-UYRXBGFRSA-NSynonyms
(5Z)5((3(4bromophenyl)1phenyl1Hpyrazol4yl)methylidene)3(prop2en1yl)2thioxo13thiazolidin4one
(5Z)5((3(4BROMOPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
C=CCN1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)Br)C4=CC=CC=C4)SC1=S
C=CCN1C(=S)SC(=Cc2cn(nc2c2ccc(cc2)Br)c2ccccc2)C1=O
InChI=1SC22H16BrN3OS2c12122521(27)19(2922(25)28)13161426(186435718)2420(16)1581017(23)11915h2111314H112H2b1913
MFCD03463496
ZINC000027017951
ZINC27017951
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