Vitas-M small molecule compound

methyl 2-chloro-5-{[(2,4-dioxo-1,3-thiazolidin-3-yl)acetyl]amino}benzoate

Catalog ID
STL412348
SMILES COC(=O)c1cc(ccc1Cl)NC(=O)CN1C(=O)CSC1=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 C13H11ClN2O5S MW 342.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11ClN2O5S/c1-21-12(19)8-4-7(2-3-9(8)14)15-10(17)5-16-11(18)6-22-13(16)20/h2-4H,5-6H2,1H3,(H,15,17)
InChIKey
WWQRYCMEXRWJEC-UHFFFAOYSA-N
Synonyms

2CHLORO5(2(24DIOXOTHIAZOLIDIN3YL)ACETYLAMINO)BENZOICACIDMETHYLESTER
COC(=O)C1=C(C=CC(=C1)NC(=O)CN2C(=O)CSC2=O)Cl
InChI=1SC13H11ClN2O5Sc12112(19)847(239(8)14)1510(17)51611(18)62213(16)20h24H56H21H3(H1517)
methyl2chloro5(((24dioxo13thiazolidin3yl)acetyl)amino)benzoate
METHYL2CHLORO5((2(24DIOXO13THIAZOLIDIN3YL)ACETYL)AMINO)BENZOATE
MFCD03923709
ZINC000004375651
ZINC04375651
ZINC4375651

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Available files

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