Vitas-M small molecule compound

3,3'-(thiophen-2-ylmethanediyl)bis(4-hydroxy-6-methylpyridin-2(1H)-one)

Catalog ID
STK854680
SMILES Oc1cc(C)[nH]c(=O)c1C(c1c(O)cc([nH]c1=O)C)c1cccs1

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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 C17H16N2O4S MW 344.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O4S/c1-8-6-10(20)13(16(22)18-8)15(12-4-3-5-24-12)14-11(21)7-9(2)19-17(14)23/h3-7,15H,1-2H3,(H2,18,20,22)(H2,19,21,23)
InChIKey
QGXSRIUDYPQCAD-UHFFFAOYSA-N
Synonyms
883084-07-9
2HYDROXY3((2HYDROXY6METHYL4OXO1HPYRIDIN3YL)THIOPHEN2YLMETHYL)6METHYL1HPYRIDIN4ONE
33(2THENYLIDENE)BIS(4HYDROXY6METHYLPYRIDINE2(1H)ONE)
33(thiophen2ylmethanediyl)bis(4hydroxy6methylpyridin2(1H)one)
33(THIOPHEN2YLMETHYLENE)BIS(4HYDROXY6METHYLPYRIDIN2(1H)ONE)
4hydroxy3((4hydroxy6methyl2oxo1Hpyridin3yl)thiophen2ylmethyl)6methyl1Hpyridin2one
883084079
CC1=CC(=C(C(=O)N1)C(C2=CC=CS2)C3=C(C=C(NC3=O)C)O)O
InChI=1SC17H16N2O4Sc18610(20)13(16(22)188)15(124352412)1411(21)79(2)1917(14)23h3715H12H3(H2182022)(H2192123)
MFCD07438078
Oc1cc(C)(nH)c(=O)c1C(c1c(O)cc((nH)c1=O)C)c1cccs1
ZINC000007424333
ZINC7424333

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Available files

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