Vitas-M small molecule compound

4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(4-methylpiperazin-1-yl)butanamide

Catalog ID
STK531717
SMILES CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)NN1CCN(CC1)C

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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 C21H28N4O2S2 MW 432.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O2S2/c1-3-16-6-8-17(9-7-16)15-18-20(27)25(21(28)29-18)10-4-5-19(26)22-24-13-11-23(2)12-14-24/h6-9,15H,3-5,10-14H2,1-2H3,(H,22,26)/b18-15-
InChIKey
LKGXUFJUQCKSOD-SDXDJHTJSA-N
Synonyms
315243-53-9
(Z)4(5(4ethylbenzylidene)4oxo2thioxothiazolidin3yl)N(4methylpiperazin1yl)butanamide
315243539
4((5Z)5((4ETHYLPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)N(4METHYLPIPERAZIN1YL)BUTANAMIDE
4((5Z)5(4ethylbenzylidene)4oxo2thioxo13thiazolidin3yl)N(4methylpiperazin1yl)butanamide
4(5(1(4ETHYLPHENYL)METH(Z)YLIDENE)4OXO2THIOXOTHIAZOLIDIN3YL)N(4METHYLPIPERAZIN1YL)BUTYRAMIDE
CCC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)NN3CCN(CC3)C
CCc1ccc(cc1)C=C1SC(=S)N(C1=O)CCCC(=O)NN1CCN(CC1)C
InChI=1SC21H28N4O2S2c13166817(9716)151820(27)25(21(28)2918)104519(26)2224131123(2)121424h6915H351014H212H3(H2226)b1815
MFCD01957114
ZINC000013122169
ZINC13122169

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Available files

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