Vitas-M small molecule compound
(5Z)-3-benzyl-5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK706411
SMILES CCOc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)Cc1ccccc1)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 C28H23N3O2S2 MW 497.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O2S2/c1-2-33-24-15-13-21(14-16-24)26-22(19-31(29-26)23-11-7-4-8-12-23)17-25-27(32)30(28(34)35-25)18-20-9-5-3-6-10-20/h3-17,19H,2,18H2,1H3/b25-17-InChIKey
RTUQNCHGJZOPGG-UQQQWYQISA-NSynonyms
313273-27-7(5Z)3benzyl5((3(4ethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3BENZYL5((3(4ETHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3benzyl5((3(4ethoxyphenyl)1phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin4one
313273277
CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4)C5=CC=CC=C5
CCOc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)Cc1ccccc1)c1ccccc1
InChI=1SC28H23N3O2S2c123324151321(141624)2622(1931(2926)23117481223)172527(32)30(28(34)3525)182095361020h31719H218H21H3b2517
MFCD01955408
ZINC000009335070
ZINC09335070
ZINC9335070
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