Vitas-M small molecule compound
(5Z)-3-ethyl-5-({3-[4-(hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK799018
SMILES CCCCCCOc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CC)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 C27H29N3O2S2 MW 491.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O2S2/c1-3-5-6-10-17-32-23-15-13-20(14-16-23)25-21(18-24-26(31)29(4-2)27(33)34-24)19-30(28-25)22-11-8-7-9-12-22/h7-9,11-16,18-19H,3-6,10,17H2,1-2H3/b24-18-InChIKey
WIFHNUYDXFBFEC-MOHJPFBDSA-NSynonyms
955888-86-5(5Z)3ethyl5((3(4(hexyloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3ETHYL5((3(4HEXOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3ethyl5((3(4(hexyloxy)phenyl)1phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin4one
955888865
CCCCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC)C4=CC=CC=C4
CCCCCCOc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)CC)c1ccccc1
InChI=1SC27H29N3O2S2c135610173223151320(141623)2521(182426(31)29(42)27(33)3424)1930(2825)22118791222h7911161819H361017H212H3b2418
MFCD03462206
ZINC000009427453
ZINC09427453
ZINC9427453
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