Vitas-M small molecule compound
5-(2,4-dimethylphenyl)-1-hydroxy-6-methyl-3-thioxo-3,5-dihydro-4H-pyrrolo[3,4-c]pyridin-4-one
Catalog ID
STL447250
SMILES Cc1ccc(c(c1)C)n1c(C)cc2c(c1=O)C(=S)N=C2O
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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 C16H14N2O2S MW 298.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O2S/c1-8-4-5-12(9(2)6-8)18-10(3)7-11-13(16(18)20)15(21)17-14(11)19/h4-7H,1-3H3,(H,17,19,21)InChIKey
FXVRPXVRISVNFR-UHFFFAOYSA-NSynonyms
5(24dimethylphenyl)1hydroxy6methyl3thioxo35dihydro4Hpyrrolo(34c)pyridin4one
5(24DIMETHYLPHENYL)6METHYL3SULFANYLIDENEPYRROLO(34C)PYRIDINE14DIONE
CC1=CC(=C(C=C1)N2C(=CC3=C(C2=O)C(=S)NC3=O)C)C
InChI=1SC16H14N2O2Sc184512(9(2)68)1810(3)71113(16(18)20)15(21)1714(11)19h47H13H3(H171921)
MFCD06244088
ZINC000006008942
ZINC6008942
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