Vitas-M small molecule compound
(5Z)-5-{[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-butyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK701414
SMILES CCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(c(c2)Br)OC)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 C24H22BrN3O2S2 MW 528.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22BrN3O2S2/c1-3-4-12-27-23(29)21(32-24(27)31)14-17-15-28(18-8-6-5-7-9-18)26-22(17)16-10-11-20(30-2)19(25)13-16/h5-11,13-15H,3-4,12H2,1-2H3/b21-14-InChIKey
HCTSWMGHQFRPCW-STZFKDTASA-NSynonyms
312314-15-1(5Z)5((3(3bromo4methoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)3butyl2thioxo13thiazolidin4one
(5Z)5((3(3BROMO4METHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3BUTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(3bromo4methoxyphenyl)1phenyl1Hpyrazol4yl)methylene)3butyl2thioxothiazolidin4one
312314151
CCCCN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OC)Br)C4=CC=CC=C4)SC1=S
CCCCN1C(=S)SC(=Cc2cn(nc2c2ccc(c(c2)Br)OC)c2ccccc2)C1=O
InChI=1SC24H22BrN3O2S2c134122723(29)21(3224(27)31)14171528(188657918)2622(17)16101120(302)19(25)1316h5111315H3412H212H3b2114
MFCD01943378
ZINC000002277108
ZINC2277108
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