Vitas-M small molecule compound

2-{(3Z)-3-[3-(2-ethylhexyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}-N-(4-fluorophenyl)acetamide

Catalog ID
STK702634
SMILES CCCCC(CN1C(=S)S/C(=C\2/c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2)F)/C1=O)CC

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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 C27H28FN3O3S2 MW 525.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28FN3O3S2/c1-3-5-8-17(4-2)15-31-26(34)24(36-27(31)35)23-20-9-6-7-10-21(20)30(25(23)33)16-22(32)29-19-13-11-18(28)12-14-19/h6-7,9-14,17H,3-5,8,15-16H2,1-2H3,(H,29,32)/b24-23-
InChIKey
FUBSYJLVZDBOCC-VHXPQNKSSA-N
Synonyms
(Z)2(3(3(2ethylhexyl)4oxo2thioxothiazolidin5ylidene)2oxoindolin1yl)N(4fluorophenyl)acetamide
2((3Z)3(3(2ETHYLHEXYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)2OXOINDOL1YL)N(4FLUOROPHENYL)ACETAMIDE
2((3Z)3(3(2ethylhexyl)4oxo2thioxo13thiazolidin5ylidene)2oxo23dihydro1Hindol1yl)N(4fluorophenyl)acetamide
CCCCC(CC)CN1C(=O)C(=C2C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC=C(C=C4)F)SC1=S
CCCCC(CN1C(=S)SC(=C2c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2)F)C1=O)CC
Registry IDs
MFCD02992510
ZINC000008817105
ZINC000008817106

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Available files

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