Vitas-M small molecule compound
(5Z)-5-({3-[4-(hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-propyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK799023
SMILES CCCCCCOc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCC)c1ccccc1
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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/c1-3-5-6-10-18-33-24-15-13-21(14-16-24)26-22(20-31(29-26)23-11-8-7-9-12-23)19-25-27(32)30(17-4-2)28(34)35-25/h7-9,11-16,19-20H,3-6,10,17-18H2,1-2H3/b25-19-InChIKey
PSOPSSVRUFGDIA-PLRJNAJWSA-NSynonyms
955866-17-8(5Z)5((3(4(hexyloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3propyl2thioxo13thiazolidin4one
(5Z)5((3(4HEXOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PROPYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4(hexyloxy)phenyl)1phenyl1Hpyrazol4yl)methylene)3propyl2thioxothiazolidin4one
955866178
CCCCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC)C4=CC=CC=C4
CCCCCCOc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)CCC)c1ccccc1
InChI=1SC28H31N3O2S2c135610183324151321(141624)2622(2031(2926)23118791223)192527(32)30(1742)28(34)3525h7911161920H36101718H212H3b2519
MFCD03462211
ZINC000009427317
ZINC09427317
ZINC9427317
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