Vitas-M small molecule compound

methyl 4-[(5E)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoate

Catalog ID
STK843443
SMILES COC(=O)c1ccc(cc1)N1C(=S)S/C(=C/c2ccc(cc2)F)/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 C18H12FNO3S2 MW 373.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12FNO3S2/c1-23-17(22)12-4-8-14(9-5-12)20-16(21)15(25-18(20)24)10-11-2-6-13(19)7-3-11/h2-10H,1H3/b15-10+
InChIKey
LATPWJKJJHFDOQ-XNTDXEJSSA-N
Synonyms
433314-92-2
(E)methyl4(5(4fluorobenzylidene)4oxo2thioxothiazolidin3yl)benzoate
433314922
COC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)F)SC2=S
COC(=O)c1ccc(cc1)N1C(=S)SC(=Cc2ccc(cc2)F)C1=O
InChI=1SC18H12FNO3S2c12317(22)124814(9512)2016(21)15(2518(20)24)10112613(19)7311h210H1H3b1510+
METHYL4((5E)5((4FLUOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BENZOATE
methyl4((5E)5(4fluorobenzylidene)4oxo2thioxo13thiazolidin3yl)benzoate
METHYL4(5((4FLUOROPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)BENZOATE
MFCD02960334
ZINC000004482825
ZINC04482825
ZINC4482825

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Available files

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