Vitas-M small molecule compound

(5Z)-3-(4-methylbenzyl)-5-({1-phenyl-3-[4-(prop-2-en-1-yloxy)phenyl]-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK814570
SMILES C=CCOc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)C)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 C30H25N3O2S2 MW 523.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N3O2S2/c1-3-17-35-26-15-13-23(14-16-26)28-24(20-33(31-28)25-7-5-4-6-8-25)18-27-29(34)32(30(36)37-27)19-22-11-9-21(2)10-12-22/h3-16,18,20H,1,17,19H2,2H3/b27-18-
InChIKey
LVJQFXSPPSCDQV-IMRQLAEWSA-N
Synonyms

(5Z)3((4METHYLPHENYL)METHYL)5((1PHENYL3(4PROP2ENOXYPHENYL)PYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3(4methylbenzyl)5((1phenyl3(4(prop2en1yloxy)phenyl)1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(Z)5((3(4(allyloxy)phenyl)1phenyl1Hpyrazol4yl)methylene)3(4methylbenzyl)2thioxothiazolidin4one
5((3(4(ALLYLOXY)PHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)3(4METHYLBENZYL)2THIOXOTHIAZOLIDIN4ONE
C=CCOc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)Cc1ccc(cc1)C)c1ccccc1
CC1=CC=C(C=C1)CN2C(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)OCC=C)C5=CC=CC=C5)SC2=S
InChI=1SC30H25N3O2S2c13173526151323(141626)2824(2033(3128)257546825)182729(34)32(30(36)3727)192211921(2)101222h3161820H11719H22H3b2718
MFCD03664764
ZINC000002370094
ZINC02370094
ZINC2370094

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Available files

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