Vitas-M small molecule compound

2-[(2-oxo-2-phenylethyl)sulfanyl]pyridine-3-carboxylic acid

Catalog ID
STK398622
SMILES O=C(c1ccccc1)CSc1ncccc1C(=O)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 C14H11NO3S MW 273.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11NO3S/c16-12(10-5-2-1-3-6-10)9-19-13-11(14(17)18)7-4-8-15-13/h1-8H,9H2,(H,17,18)
InChIKey
MJHMABNIGSEYKN-UHFFFAOYSA-N
Synonyms
142221-23-6
142221236
2((2oxo2phenylethyl)sulfanyl)pyridine3carboxylicacid
2((2OXO2PHENYLETHYL)THIO)NICOTINICACID
2(2OXO2PHENYLETHYLSULFANYL)NICOTINICACID
2(2OXO2PHENYLETHYLTHIO)PYRIDINE3CARBOXYLICACID
2PHENACYLSULFANYLPYRIDINE3CARBOXYLICACID
C1=CC=C(C=C1)C(=O)CSC2=C(C=CC=N2)C(=O)O
InChI=1SC14H11NO3Sc1612(105213610)9191311(14(17)18)7481513h18H9H2(H1718)
MFCD00791575
ZINC000002451124
ZINC2451124

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Available files

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