Vitas-M small molecule compound
(5E)-5-(2,3-dimethoxybenzylidene)-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK815395
SMILES COc1c(cccc1OC)/C=C\1/SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C
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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 C23H21N3O4S2 MW 467.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O4S2/c1-14-19(22(28)26(24(14)2)16-10-6-5-7-11-16)25-21(27)18(32-23(25)31)13-15-9-8-12-17(29-3)20(15)30-4/h5-13H,1-4H3/b18-13+InChIKey
WSEQHHYBFHIPAU-QGOAFFKASA-NSynonyms
(5E)5((23DIMETHOXYPHENYL)METHYLIDENE)3(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)5(23dimethoxybenzylidene)3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)2thioxo13thiazolidin4one
(Z)5(23dimethoxybenzylidene)3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)2thioxothiazolidin4one
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=O)C(=CC4=C(C(=CC=C4)OC)OC)SC3=S
COc1c(cccc1OC)C=C1SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C
InChI=1SC23H21N3O4S2c11419(22(28)26(24(14)2)16106571116)2521(27)18(3223(25)31)1315981217(293)20(15)304h513H14H3b1813+
MFCD04442650
ZINC000026503264
ZINC26503264
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