Vitas-M small molecule compound
(5Z)-5-{[3-(3-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK706873
SMILES CCOc1cccc(c1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CC1CCCO1)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 C26H25N3O3S2 MW 491.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O3S2/c1-2-31-21-11-6-8-18(14-21)24-19(16-29(27-24)20-9-4-3-5-10-20)15-23-25(30)28(26(33)34-23)17-22-12-7-13-32-22/h3-6,8-11,14-16,22H,2,7,12-13,17H2,1H3/b23-15-InChIKey
KJQMGJQORXCTRH-HAHDFKILSA-NSynonyms
1009189-71-2(5Z)5((3(3ethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin4one
(5Z)5((3(3ETHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(OXOLAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(3ethoxyphenyl)1phenyl1Hpyrazol4yl)methylene)3((tetrahydrofuran2yl)methyl)2thioxothiazolidin4one
1009189712
CCOC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC4CCCO4)C5=CC=CC=C5
InChI=1SC26H25N3O3S2c123121116818(1421)2419(1629(2724)2094351020)152325(30)28(26(33)3423)1722127133222h36811141622H27121317H21H3b2315
MFCD04022301
ZINC000002349386
ZINC000013748531
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