Vitas-M small molecule compound

methyl 3-(3-chloro-4-fluorophenyl)-3-(5-hydroxy-2,1,3-benzothiadiazol-4-yl)propanoate

Catalog ID
STL410048
SMILES COC(=O)CC(c1c(O)ccc2c1nsn2)c1ccc(c(c1)Cl)F

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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 C16H12ClFN2O3S MW 366.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClFN2O3S/c1-23-14(22)7-9(8-2-3-11(18)10(17)6-8)15-13(21)5-4-12-16(15)20-24-19-12/h2-6,9,21H,7H2,1H3
InChIKey
NKQQJASJWDITEX-UHFFFAOYSA-N
Synonyms
1574300-42-7
1574300427
methyl3(3chloro4fluorophenyl)3(5hydroxy213benzothiadiazol4yl)propanoate
methyl3(3chloro4fluorophenyl)3(5hydroxybenzo(c)(125)thiadiazol4yl)propanoate
MFCD28057830
ZINC000096222961
ZINC000096222962

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Available files

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