Vitas-M small molecule compound
2-[(5Z)-5-(2,3-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-methylbutanoic acid
Catalog ID
STK552696
SMILES COc1c(cccc1OC)/C=C/1\SC(=S)N(C1=O)C(C(=O)O)C(C)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 C17H19NO5S2 MW 381.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO5S2/c1-9(2)13(16(20)21)18-15(19)12(25-17(18)24)8-10-6-5-7-11(22-3)14(10)23-4/h5-9,13H,1-4H3,(H,20,21)/b12-8-InChIKey
PJEKOILLZDITLD-WQLSENKSSA-NSynonyms
(Z)2(5(23dimethoxybenzylidene)4oxo2thioxothiazolidin3yl)3methylbutanoicacid
2((5Z)5((23DIMETHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)3METHYLBUTANOICACID
2((5Z)5(23dimethoxybenzylidene)4oxo2thioxo13thiazolidin3yl)3methylbutanoicacid
CC(C)C(C(=O)O)N1C(=O)C(=CC2=C(C(=CC=C2)OC)OC)SC1=S
COc1c(cccc1OC)C=C1SC(=S)N(C1=O)C(C(=O)O)C(C)C
InChI=1SC17H19NO5S2c19(2)13(16(20)21)1815(19)12(2517(18)24)81065711(223)14(10)234h5913H14H3(H2021)b128
MFCD03686533
ZINC000001299260
ZINC000001299262
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