Vitas-M small molecule compound

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

Catalog ID
STL297667
SMILES CCC(N1C(=S)S/C(=C\c2ccc(cc2)OC)/C1=O)C(=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 C15H15NO4S2 MW 337.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15NO4S2/c1-3-11(14(18)19)16-13(17)12(22-15(16)21)8-9-4-6-10(20-2)7-5-9/h4-8,11H,3H2,1-2H3,(H,18,19)/b12-8-
InChIKey
HOLCHLAHTMVSIU-WQLSENKSSA-N
Synonyms
303056-09-9
(Z)2(5(4methoxybenzylidene)4oxo2thioxothiazolidin3yl)butanoicacid
2((5Z)5((4METHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
2((5Z)5(4methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
2(5((4METHOXYPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)BUTANOICACID
2(5(4METHOXYBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)BUTANOICACID
2(5(4METHOXYBENZYLIDENE)4OXO2THIOXOTHIAZOLIDIN3YL)BUTYRICACID
303056099
CCC(C(=O)O)N1C(=O)C(=CC2=CC=C(C=C2)OC)SC1=S
CCC(N1C(=S)SC(=Cc2ccc(cc2)OC)C1=O)C(=O)O
InChI=1SC15H15NO4S2c1311(14(18)19)1613(17)12(2215(16)21)894610(202)759h4811H3H212H3(H1819)b128
MFCD01162123
ZINC000002059774
ZINC000002059776

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Available files

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