Vitas-M small molecule compound
(5Z)-5-{[3-(4-ethoxy-3-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-[2-(4-methoxyphenyl)ethyl]-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK812810
SMILES CCOc1ccc(cc1F)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCc1ccc(cc1)OC)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 C30H26FN3O3S2 MW 559.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26FN3O3S2/c1-3-37-26-14-11-21(17-25(26)31)28-22(19-34(32-28)23-7-5-4-6-8-23)18-27-29(35)33(30(38)39-27)16-15-20-9-12-24(36-2)13-10-20/h4-14,17-19H,3,15-16H2,1-2H3/b27-18-InChIKey
IIXYSSGQIDFUMK-IMRQLAEWSA-NSynonyms
(5Z)5((3(4ethoxy3fluorophenyl)1phenyl1Hpyrazol4yl)methylidene)3(2(4methoxyphenyl)ethyl)2thioxo13thiazolidin4one
(5Z)5((3(4ETHOXY3FLUOROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(2(4METHOXYPHENYL)ETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC4=CC=C(C=C4)OC)C5=CC=CC=C5)F
CCOc1ccc(cc1F)c1nn(cc1C=C1SC(=S)N(C1=O)CCc1ccc(cc1)OC)c1ccccc1
InChI=1SC30H26FN3O3S2c133726141121(1725(26)31)2822(1934(3228)237546823)182729(35)33(30(38)3927)16152091224(362)131020h4141719H31516H212H3b2718
MFCD06265081
ZINC000097946492
ZINC97946492
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