Vitas-M small molecule compound

3-[(4-methylquinolin-2-yl)sulfanyl]propanoic acid

Catalog ID
STK050870
SMILES OC(=O)CCSc1cc(C)c2c(n1)cccc2

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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 C13H13NO2S MW 247.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13NO2S/c1-9-8-12(17-7-6-13(15)16)14-11-5-3-2-4-10(9)11/h2-5,8H,6-7H2,1H3,(H,15,16)
InChIKey
FQBIMWFPTSDHNL-UHFFFAOYSA-N
Synonyms
364341-27-5
3((4METHYLQUINOLIN2YL)SULFANYL)PROPANOICACID
3((4methylquinolin2yl)thio)propanoicacid
3(4METHYL2QUINOLYLTHIO)PROPANOICACID
3(4METHYLQUINOLIN2YL)SULFANYLPROPANOICACID
364341275
CC1=CC(=NC2=CC=CC=C12)SCCC(=O)O
InChI=1SC13H13NO2Sc19812(177613(15)16)1411532410(9)11h258H67H21H3(H1516)
MFCD03000436
OC(=O)CCSc1cc(C)c2c(n1)cccc2
STK050870
ZINC000000524417
ZINC524417

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Available files

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