Vitas-M small molecule compound
2-[(5Z)-5-(3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-methylbutanoic acid
Catalog ID
STK994798
SMILES COc1cccc(c1)/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 C16H17NO4S2 MW 351.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO4S2/c1-9(2)13(15(19)20)17-14(18)12(23-16(17)22)8-10-5-4-6-11(7-10)21-3/h4-9,13H,1-3H3,(H,19,20)/b12-8-InChIKey
MPDTWZMDASDWNU-WQLSENKSSA-NSynonyms
2((5Z)5((3METHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)3METHYLBUTANOICACID
2((5Z)5(3methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)3methylbutanoicacid
2(5((3METHOXYPHENYL)METHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))3METHYLBUTANOICACID
CC(C)C(C(=O)O)N1C(=O)C(=CC2=CC(=CC=C2)OC)SC1=S
COc1cccc(c1)C=C1SC(=S)N(C1=O)C(C(=O)O)C(C)C
InChI=1SC16H17NO4S2c19(2)13(15(19)20)1714(18)12(2316(17)22)81054611(710)213h4913H13H3(H1920)b128
MFCD00710959
ZINC000001786506
ZINC000001786510
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