Vitas-M small molecule compound
(5Z)-3-(4-methoxybenzyl)-5-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK598085
SMILES COc1ccc(cc1)CN1C(=S)S/C(=C\c2ccc3c(c2)CC(O3)C)/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 C21H19NO3S2 MW 397.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO3S2/c1-13-9-16-10-15(5-8-18(16)25-13)11-19-20(23)22(21(26)27-19)12-14-3-6-17(24-2)7-4-14/h3-8,10-11,13H,9,12H2,1-2H3/b19-11-InChIKey
JQKQNEODIJTSSE-ODLFYWEKSA-NSynonyms
873080-42-3(5Z)3((4METHOXYPHENYL)METHYL)5((2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3(4methoxybenzyl)5((2methyl23dihydro1benzofuran5yl)methylidene)2thioxo13thiazolidin4one
(Z)3(4methoxybenzyl)5((2methyl23dihydrobenzofuran5yl)methylene)2thioxothiazolidin4one
873080423
CC1CC2=C(O1)C=CC(=C2)C=C3C(=O)N(C(=S)S3)CC4=CC=C(C=C4)OC
COc1ccc(cc1)CN1C(=S)SC(=Cc2ccc3c(c2)CC(O3)C)C1=O
InChI=1SC21H19NO3S2c1139161015(5818(16)2513)111920(23)22(21(26)2719)12143617(242)7414h38101113H912H212H3b1911
MFCD06600480
ZINC000002225197
ZINC000002225201
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