Vitas-M small molecule compound
(5Z)-5-{[3-(3-fluoro-4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(3-methoxypropyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK880852
SMILES COCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(c(c2)F)C)c2ccccc2)/C1=O
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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 C24H22FN3O2S2 MW 467.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22FN3O2S2/c1-16-9-10-17(13-20(16)25)22-18(15-28(26-22)19-7-4-3-5-8-19)14-21-23(29)27(24(31)32-21)11-6-12-30-2/h3-5,7-10,13-15H,6,11-12H2,1-2H3/b21-14-InChIKey
OCKQBLVDEQJAJH-STZFKDTASA-NSynonyms
(5Z)5((3(3fluoro4methylphenyl)1phenyl1Hpyrazol4yl)methylidene)3(3methoxypropyl)2thioxo13thiazolidin4one
(5Z)5((3(3FLUORO4METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(3METHOXYPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
5((3(3FLUORO4METHYLPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)3(3METHOXYPROPYL)2THIOXOTHIAZOLIDIN4ONE
CC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCCOC)C4=CC=CC=C4)F
COCCCN1C(=S)SC(=Cc2cn(nc2c2ccc(c(c2)F)C)c2ccccc2)C1=O
InChI=1SC24H22FN3O2S2c11691017(1320(16)25)2218(1528(2622)197435819)142123(29)27(24(31)3221)11612302h357101315H61112H212H3b2114
MFCD04441402
ZINC000002533077
ZINC02533077
ZINC2533077
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