Vitas-M small molecule compound
(5Z)-3-ethyl-5-{[3-(7-methoxy-1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK818681
SMILES CCN1C(=S)S/C(=C\c2cn(nc2c2cc3c(o2)c(OC)ccc3)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 C24H19N3O3S2 MW 461.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19N3O3S2/c1-3-26-23(28)20(32-24(26)31)13-16-14-27(17-9-5-4-6-10-17)25-21(16)19-12-15-8-7-11-18(29-2)22(15)30-19/h4-14H,3H2,1-2H3/b20-13-InChIKey
SPWPUBVKLBXCSI-MOSHPQCFSA-NSynonyms
(5Z)3ethyl5((3(7methoxy1benzofuran2yl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3ethyl5((3(7methoxy1benzofuran2yl)1phenylpyrazol4yl)methylidene)2sulfanylidene13thiazolidin4one
CCN1C(=O)C(=CC2=CN(N=C2C3=CC4=C(O3)C(=CC=C4)OC)C5=CC=CC=C5)SC1=S
CCN1C(=S)SC(=Cc2cn(nc2c2cc3c(o2)c(OC)ccc3)c2ccccc2)C1=O
InChI=1SC24H19N3O3S2c132623(28)20(3224(26)31)13161427(1795461017)2521(16)191215871118(292)22(15)3019h414H3H212H3b2013
MFCD04447986
ZINC000016736976
ZINC16736976
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