Vitas-M small molecule compound
(5Z)-5-{[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-propyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK701912
SMILES CCCN1C(=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 C23H20BrN3O2S2 MW 514.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20BrN3O2S2/c1-3-11-26-22(28)20(31-23(26)30)13-16-14-27(17-7-5-4-6-8-17)25-21(16)15-9-10-19(29-2)18(24)12-15/h4-10,12-14H,3,11H2,1-2H3/b20-13-InChIKey
WDIFCBRFMQCBMR-MOSHPQCFSA-NSynonyms
(5Z)5((3(3bromo4methoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)3propyl2thioxo13thiazolidin4one
(5Z)5((3(3BROMO4METHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PROPYL2SULFANYLIDENE13THIAZOLIDIN4ONE
CCCN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OC)Br)C4=CC=CC=C4)SC1=S
CCCN1C(=S)SC(=Cc2cn(nc2c2ccc(c(c2)Br)OC)c2ccccc2)C1=O
InChI=1SC23H20BrN3O2S2c13112622(28)20(3123(26)30)13161427(177546817)2521(16)1591019(292)18(24)1215h4101214H311H212H3b2013
MFCD03461682
ZINC000002696933
ZINC02696933
ZINC2696933
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