Vitas-M small molecule compound
(5Z)-5-{[3-(1,3-benzothiazol-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(butan-2-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK880775
SMILES CCC(N1C(=S)S/C(=C\c2cn(nc2c2nc3c(s2)cccc3)c2ccccc2)/C1=O)C
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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 C24H20N4OS3 MW 476.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N4OS3/c1-3-15(2)28-23(29)20(32-24(28)30)13-16-14-27(17-9-5-4-6-10-17)26-21(16)22-25-18-11-7-8-12-19(18)31-22/h4-15H,3H2,1-2H3/b20-13-InChIKey
CFXJTFARHCDWTB-MOSHPQCFSA-NSynonyms
(5Z)5((3(13benzothiazol2yl)1phenyl1Hpyrazol4yl)methylidene)3(butan2yl)2thioxo13thiazolidin4one
(5Z)5((3(13BENZOTHIAZOL2YL)1PHENYLPYRAZOL4YL)METHYLIDENE)3BUTAN2YL2SULFANYLIDENE13THIAZOLIDIN4ONE
CCC(C)N1C(=O)C(=CC2=CN(N=C2C3=NC4=CC=CC=C4S3)C5=CC=CC=C5)SC1=S
CCC(N1C(=S)SC(=Cc2cn(nc2c2nc3c(s2)cccc3)c2ccccc2)C1=O)C
InChI=1SC24H20N4OS3c1315(2)2823(29)20(3224(28)30)13161427(1795461017)2621(16)22251811781219(18)3122h415H3H212H3b2013
MFCD04441347
ZINC000016729725
ZINC000016729729
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