Vitas-M small molecule compound
(5Z)-5-[3-chloro-5-ethoxy-4-(prop-2-en-1-yloxy)benzylidene]-3-(pyridin-3-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL369259
SMILES C=CCOc1c(Cl)cc(cc1OCC)/C=C/1\SC(=S)N(C1=O)Cc1cccnc1
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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 C21H19ClN2O3S2 MW 446.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O3S2/c1-3-8-27-19-16(22)9-15(10-17(19)26-4-2)11-18-20(25)24(21(28)29-18)13-14-6-5-7-23-12-14/h3,5-7,9-12H,1,4,8,13H2,2H3/b18-11-InChIKey
CECUMLHDOIRQEK-WQRHYEAKSA-NSynonyms
(5Z)5((3CHLORO5ETHOXY4PROP2ENOXYPHENYL)METHYLIDENE)3(PYRIDIN3YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(3chloro5ethoxy4(prop2en1yloxy)benzylidene)3(pyridin3ylmethyl)2thioxo13thiazolidin4one
C=CCOc1c(Cl)cc(cc1OCC)C=C1SC(=S)N(C1=O)Cc1cccnc1
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CN=CC=C3)Cl)OCC=C
InChI=1SC21H19ClN2O3S2c138271916(22)915(1017(19)2642)111820(25)24(21(28)2918)1314657231214h357912H14813H22H3b1811
MFCD03705389
ZINC000015010792
ZINC15010792
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