Vitas-M small molecule compound

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

Catalog ID
STK027473
SMILES COC(=O)c1ccc(cc1)/C=C\1/SC(=S)N(C1=O)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 C13H11NO3S2 MW 293.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11NO3S2/c1-14-11(15)10(19-13(14)18)7-8-3-5-9(6-4-8)12(16)17-2/h3-7H,1-2H3/b10-7+
InChIKey
TYCJVBWFKORJAZ-JXMROGBWSA-N
Synonyms

CN1C(=O)C(=CC2=CC=C(C=C2)C(=O)OC)SC1=S
COC(=O)c1ccc(cc1)C=C1SC(=S)N(C1=O)C
InChI=1SC13H11NO3S2c11411(15)10(1913(14)18)78359(648)12(16)172h37H12H3b107+
METHYL4((3METHYL4OXO2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)BENZOATE
METHYL4((E)(3METHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)BENZOATE
METHYL4((E)(3METHYL4OXO2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)BENZOATE
MFCD00617412
STK027473
ZINC000004602081
ZINC04602081
ZINC4602081

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Available files

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