Vitas-M small molecule compound
(5Z)-3-(4-methoxybenzyl)-5-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK810864
SMILES COc1ccc(cc1)CN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2)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 C28H23N3O2S2 MW 497.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O2S2/c1-19-8-12-21(13-9-19)26-22(18-31(29-26)23-6-4-3-5-7-23)16-25-27(32)30(28(34)35-25)17-20-10-14-24(33-2)15-11-20/h3-16,18H,17H2,1-2H3/b25-16-InChIKey
MERDFWDFTUAMTR-XYGWBWBKSA-NSynonyms
955964-95-1(5Z)3((4METHOXYPHENYL)METHYL)5((3(4METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3(4methoxybenzyl)5((3(4methylphenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(Z)3(4methoxybenzyl)5((1phenyl3(ptolyl)1Hpyrazol4yl)methylene)2thioxothiazolidin4one
955964951
CC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC4=CC=C(C=C4)OC)C5=CC=CC=C5
COc1ccc(cc1)CN1C(=S)SC(=Cc2cn(nc2c2ccc(cc2)C)c2ccccc2)C1=O
InChI=1SC28H23N3O2S2c11981221(13919)2622(1831(2926)236435723)162527(32)30(28(34)3525)1720101424(332)151120h31618H17H212H3b2516
MFCD03664702
ZINC000001763474
ZINC01763474
ZINC1763474
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