Vitas-M small molecule compound
(5Z)-5-{[3-(3-chloro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK813752
SMILES COc1ccc(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 C20H14ClN3O2S2 MW 427.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14ClN3O2S2/c1-26-16-8-7-12(9-15(16)21)18-13(10-17-19(25)22-20(27)28-17)11-24(23-18)14-5-3-2-4-6-14/h2-11H,1H3,(H,22,25,27)/b17-10-InChIKey
VPEPHKBCKURXSO-YVLHZVERSA-NSynonyms
(5Z)5((3(3chloro4methoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)5((3(3CHLORO4METHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
COC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)NC(=S)S3)C4=CC=CC=C4)Cl
COc1ccc(cc1Cl)c1nn(cc1C=C1SC(=S)NC1=O)c1ccccc1
InChI=1SC20H14ClN3O2S2c126168712(915(16)21)1813(101719(25)2220(27)2817)1124(2318)145324614h211H1H3(H222527)b1710
MFCD03514176
ZINC000016805504
ZINC16805504
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