Vitas-M small molecule compound
4-(5-bromothiophen-2-yl)-2-hydroxy-7,7-dimethyl-4,7-dihydrofuro[3,4-b]pyridin-5(3H)-one
Catalog ID
STL248388
SMILES OC1=NC2=C(C(C1)c1ccc(s1)Br)C(=O)OC2(C)C
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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 C13H12BrNO3S MW 342.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12BrNO3S/c1-13(2)11-10(12(17)18-13)6(5-9(16)15-11)7-3-4-8(14)19-7/h3-4,6H,5H2,1-2H3,(H,15,16)InChIKey
KJHORUNLXCRCKE-UHFFFAOYSA-NSynonyms
1351681-02-11351681021
4(5bromothiophen2yl)2hydroxy77dimethyl47dihydrofuro(34b)pyridin5(3H)one
4(5bromothiophen2yl)77dimethyl34dihydro1Hfuro(34b)pyridine25dione
CC1(C2=C(C(CC(=O)N2)C3=CC=C(S3)Br)C(=O)O1)C
InChI=1SC13H12BrNO3Sc113(2)1110(12(17)1813)6(59(16)1511)7348(14)197h346H5H212H3(H1516)
MFCD24861182
ZINC000101722360
ZINC000101722363
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