Vitas-M small molecule compound

ethyl 4-[(3-{(5Z)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoyl)amino]benzoate

Catalog ID
STK994638
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CCN1C(=S)S/C(=C\C(=C\c2ccccc2)\C)/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 C25H24N2O4S2 MW 480.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O4S2/c1-3-31-24(30)19-9-11-20(12-10-19)26-22(28)13-14-27-23(29)21(33-25(27)32)16-17(2)15-18-7-5-4-6-8-18/h4-12,15-16H,3,13-14H2,1-2H3,(H,26,28)/b17-15+,21-16-
InChIKey
NFLKWFDEPAPYKB-AMQBKCJUSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=O)C(=CC(=CC3=CC=CC=C3)C)SC2=S
CCOC(=O)c1ccc(cc1)NC(=O)CCN1C(=S)SC(=CC(=Cc2ccccc2)C)C1=O
ethyl4((3((5Z)5((2E)2methyl3phenylprop2en1ylidene)4oxo2thioxo13thiazolidin3yl)propanoyl)amino)benzoate
ETHYL4(3((5Z)5((E)2METHYL3PHENYLPROP2ENYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOYLAMINO)BENZOATE
ETHYL4(3(5((2E)2METHYL3PHENYLPROP2ENYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)PROPANOYLAMINO)BENZOATE
InChI=1SC25H24N2O4S2c133124(30)1991120(121019)2622(28)13142723(29)21(3325(27)32)1617(2)15187546818h4121516H31314H212H3(H2628)b1715+2116
MFCD03226138
ZINC000009444158
ZINC09444158
ZINC9444158

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Available files

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