Vitas-M small molecule compound

[(5Z)-5-(3,4-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid

Catalog ID
STK387344
SMILES COc1cc(ccc1OC)/C=C/1\SC(=S)N(C1=O)CC(=O)O

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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 C14H13NO5S2 MW 339.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13NO5S2/c1-19-9-4-3-8(5-10(9)20-2)6-11-13(18)15(7-12(16)17)14(21)22-11/h3-6H,7H2,1-2H3,(H,16,17)/b11-6-
InChIKey
YRODMNNSVWBMBR-WDZFZDKYSA-N
Synonyms
1474053-36-5
((5Z)5(34DIMETHOXYBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
(5(34DIMETHOXYBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
(5(34DIMETHOXYBENZYLIDENE)4OXO2THIOXOTHIAZOLIDIN3YL)ACETICACID
(Z)2(5(34dimethoxybenzylidene)4oxo2thioxothiazolidin3yl)aceticacid
1474053365
2((5Z)5((34dimethoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
COC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)CC(=O)O)OC
COc1cc(ccc1OC)C=C1SC(=S)N(C1=O)CC(=O)O
InChI=1SC14H13NO5S2c1199438(510(9)202)61113(18)15(712(16)17)14(21)2211h36H7H212H3(H1617)b116
MFCD00590488
ZINC000012504547
ZINC12504547

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.