Vitas-M small molecule compound
(5Z)-5-{[3-(3-chloro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-cyclopentyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK813748
SMILES COc1ccc(cc1Cl)c1nn(cc1/C=C/1\SC(=S)N(C1=O)C1CCCC1)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 C25H22ClN3O2S2 MW 496.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O2S2/c1-31-21-12-11-16(13-20(21)26)23-17(15-28(27-23)18-7-3-2-4-8-18)14-22-24(30)29(25(32)33-22)19-9-5-6-10-19/h2-4,7-8,11-15,19H,5-6,9-10H2,1H3/b22-14-InChIKey
JQHZXLSVOJGAEU-HMAPJEAMSA-NSynonyms
(5Z)5((3(3chloro4methoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)3cyclopentyl2thioxo13thiazolidin4one
(5Z)5((3(3CHLORO4METHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3CYCLOPENTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
5((3(3CHLORO4METHOXYPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)3CYCLOPENTYL2THIOXOTHIAZOLIDIN4ONE
COC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C4CCCC4)C5=CC=CC=C5)Cl
COc1ccc(cc1Cl)c1nn(cc1C=C1SC(=S)N(C1=O)C1CCCC1)c1ccccc1
InChI=1SC25H22ClN3O2S2c13121121116(1320(21)26)2317(1528(2723)187324818)142224(30)29(25(32)3322)199561019h2478111519H56910H21H3b2214
MFCD04441748
ZINC000002533277
ZINC02533277
ZINC2533277
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