Vitas-M small molecule compound
(5Z)-5-({3-[3-methyl-4-(propan-2-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-pentyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK702956
SMILES CCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(c(c2)C)OC(C)C)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 C28H31N3O2S2 MW 505.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O2S2/c1-5-6-10-15-30-27(32)25(35-28(30)34)17-22-18-31(23-11-8-7-9-12-23)29-26(22)21-13-14-24(20(4)16-21)33-19(2)3/h7-9,11-14,16-19H,5-6,10,15H2,1-4H3/b25-17-InChIKey
BURMZVPGDBBIPN-UQQQWYQISA-NSynonyms
(5Z)5((3(3methyl4(propan2yloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3pentyl2thioxo13thiazolidin4one
(5Z)5((3(3METHYL4PROPAN2YLOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PENTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4isopropoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)3pentyl2thioxothiazolidin4one
CCCCCN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OC(C)C)C)C4=CC=CC=C4)SC1=S
CCCCCN1C(=S)SC(=Cc2cn(nc2c2ccc(c(c2)C)OC(C)C)c2ccccc2)C1=O
InChI=1SC28H31N3O2S2c15610153027(32)25(3528(30)34)17221831(23118791223)2926(22)21131424(20(4)1621)3319(2)3h7911141619H561015H214H3b2517
MFCD02988913
ZINC000002228456
ZINC02228456
ZINC2228456
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