Vitas-M small molecule compound

(5Z)-5-{[3-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK815639
SMILES CC1Oc2c(C1)cc(cc2)c1nn(cc1/C=C/1\SC(=S)NC1=O)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 C22H17N3O2S2 MW 419.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O2S2/c1-13-9-15-10-14(7-8-18(15)27-13)20-16(11-19-21(26)23-22(28)29-19)12-25(24-20)17-5-3-2-4-6-17/h2-8,10-13H,9H2,1H3,(H,23,26,28)/b19-11-
InChIKey
MVXDMRREHDVWQH-ODLFYWEKSA-N
Synonyms
956987-22-7
(5Z)5((3(2methyl23dihydro1benzofuran5yl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)5((3(2METHYL23DIHYDRO1BENZOFURAN5YL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
956987227
CC1CC2=C(O1)C=CC(=C2)C3=NN(C=C3C=C4C(=O)NC(=S)S4)C5=CC=CC=C5
CC1Oc2c(C1)cc(cc2)c1nn(cc1C=C1SC(=S)NC1=O)c1ccccc1
InChI=1SC22H17N3O2S2c1139151014(7818(15)2713)2016(111921(26)2322(28)2919)1225(2420)175324617h281013H9H21H3(H232628)b1911
MFCD03763302
ZINC000001096517
ZINC000015226405

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Available files

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