Vitas-M small molecule compound
(5Z)-5-{[3-(3-fluoro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-methyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK813828
SMILES COc1ccc(cc1F)c1nn(cc1/C=C/1\SC(=S)N(C1=O)C)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 C21H16FN3O2S2 MW 425.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16FN3O2S2/c1-24-20(26)18(29-21(24)28)11-14-12-25(15-6-4-3-5-7-15)23-19(14)13-8-9-17(27-2)16(22)10-13/h3-12H,1-2H3/b18-11-InChIKey
LSWBYFSPXXCFQP-WQRHYEAKSA-NSynonyms
(5Z)5((3(3fluoro4methoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)3methyl2thioxo13thiazolidin4one
(5Z)5((3(3FLUORO4METHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3METHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
5((3(3FLUORO4METHOXYPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)3METHYL2THIOXOTHIAZOLIDIN4ONE
CN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OC)F)C4=CC=CC=C4)SC1=S
COc1ccc(cc1F)c1nn(cc1C=C1SC(=S)N(C1=O)C)c1ccccc1
InChI=1SC21H16FN3O2S2c12420(26)18(2921(24)28)11141225(156435715)2319(14)138917(272)16(22)1013h312H12H3b1811
MFCD03506445
ZINC000001130773
ZINC01130773
ZINC1130773
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