Vitas-M small molecule compound

butyl 3-[(5E)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoate

Catalog ID
STK994264
SMILES CCCCOC(=O)CCN1C(=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/c1-3-5-12-23-17(21)10-11-20-18(22)16(25-19(20)24)13-15-8-6-14(4-2)7-9-15/h6-9,13H,3-5,10-12H2,1-2H3/b16-13+
InChIKey
RHWSTNZSAHNRGX-DTQAZKPQSA-N
Synonyms

BUTYL3((5E)5((4ETHYLPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOATE
butyl3((5E)5(4ethylbenzylidene)4oxo2thioxo13thiazolidin3yl)propanoate
CCCCOC(=O)CCN1C(=O)C(=CC2=CC=C(C=C2)CC)SC1=S
CCCCOC(=O)CCN1C(=S)SC(=Cc2ccc(cc2)CC)C1=O
InChI=1SC19H23NO3S2c135122317(21)10112018(22)16(2519(20)24)13158614(42)7915h6913H351012H212H3b1613+
MFCD18185056
ZINC000006359224
ZINC06359224
ZINC6359224

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Available files

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