Vitas-M small molecule compound

(5Z)-5-{[3-(3-chloro-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK816168
SMILES CCCOc1ccc(cc1Cl)c1nn(cc1/C=C/1\SC(=S)NC1=O)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 C22H18ClN3O2S2 MW 455.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN3O2S2/c1-2-10-28-18-9-8-14(11-17(18)23)20-15(12-19-21(27)24-22(29)30-19)13-26(25-20)16-6-4-3-5-7-16/h3-9,11-13H,2,10H2,1H3,(H,24,27,29)/b19-12-
InChIKey
DYWRYASRRUDLNG-UNOMPAQXSA-N
Synonyms
956049-44-8
(5Z)5((3(3chloro4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)5((3(3CHLORO4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(3chloro4propoxyphenyl)1phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin4one
956049448
CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)NC(=S)S3)C4=CC=CC=C4)Cl
CCCOc1ccc(cc1Cl)c1nn(cc1C=C1SC(=S)NC1=O)c1ccccc1
InChI=1SC22H18ClN3O2S2c121028189814(1117(18)23)2015(121921(27)2422(29)3019)1326(2520)166435716h391113H210H21H3(H242729)b1912
MFCD04005067
ZINC000002594799
ZINC02594799
ZINC13750469
ZINC2594799

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Available files

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