Vitas-M small molecule compound

methyl 6-[(5E)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoate

Catalog ID
STL331213
SMILES COC(=O)CCCCCN1C(=S)S/C(=C/c2ccc(cc2)CC)/C1=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 C19H23NO3S2 MW 377.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23NO3S2/c1-3-14-8-10-15(11-9-14)13-16-18(22)20(19(24)25-16)12-6-4-5-7-17(21)23-2/h8-11,13H,3-7,12H2,1-2H3/b16-13+
InChIKey
YGUGWXLWFQCVPF-DTQAZKPQSA-N
Synonyms
347365-62-2
(E)methyl6(5(4ethylbenzylidene)4oxo2thioxothiazolidin3yl)hexanoate
347365622
CCC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCCCC(=O)OC
COC(=O)CCCCCN1C(=S)SC(=Cc2ccc(cc2)CC)C1=O
InChI=1SC19H23NO3S2c131481015(11914)131618(22)20(19(24)2516)12645717(21)232h81113H3712H212H3b1613+
METHYL6((5E)5((4ETHYLPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOATE
methyl6((5E)5(4ethylbenzylidene)4oxo2thioxo13thiazolidin3yl)hexanoate
METHYL6(5((4ETHYLPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)HEXANOATE
MFCD02333567
ZINC000001768368
ZINC01768368
ZINC1768368

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Available files

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