Vitas-M small molecule compound
5-cyclohexyl-1-hydroxy-6-methyl-3-thioxo-3,5-dihydro-4H-pyrrolo[3,4-c]pyridin-4-one
Catalog ID
STL447247
SMILES S=C1N=C(c2c1c(=O)n(c(c2)C)C1CCCCC1)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 C14H16N2O2S MW 276.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2O2S/c1-8-7-10-11(13(19)15-12(10)17)14(18)16(8)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3,(H,15,17,19)InChIKey
CRUJWBQIUMPTDO-UHFFFAOYSA-NSynonyms
5cyclohexyl1hydroxy6methyl3thioxo35dihydro4Hpyrrolo(34c)pyridin4one
5CYCLOHEXYL6METHYL3SULFANYLIDENEPYRROLO(34C)PYRIDINE14DIONE
CC1=CC2=C(C(=S)NC2=O)C(=O)N1C3CCCCC3
InChI=1SC14H16N2O2Sc1871011(13(19)1512(10)17)14(18)16(8)9532469h79H26H21H3(H151719)
MFCD06244876
ZINC000006008847
ZINC6008847
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