Vitas-M small molecule compound
2-[(E)-2-(5-bromo-1H-indol-3-yl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Catalog ID
STK255874
SMILES Brc1ccc2c(c1)c(/C=C/c1nc(O)c(c(=O)[nH]1)[N+](=O)[O-])c[nH]2
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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 C14H9BrN4O4 MW 377.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H9BrN4O4/c15-8-2-3-10-9(5-8)7(6-16-10)1-4-11-17-13(20)12(19(22)23)14(21)18-11/h1-6,16H,(H2,17,18,20,21)/b4-1+InChIKey
RLSABCGBXGRBKO-DAFODLJHSA-NSynonyms
2((E)2(5bromo1Hindol3yl)ethenyl)4hydroxy5nitro1Hpyrimidin6one
2((E)2(5bromo1Hindol3yl)ethenyl)6hydroxy5nitropyrimidin4(3H)one
Brc1ccc2c(c1)c(C=Cc1nc(O)c(c(=O)(nH)1)(N+)(=O)(O))c(nH)2
C1=CC2=C(C=C1Br)C(=CN2)C=CC3=NC(=C(C(=O)N3)(N+)(=O)(O))O
InChI=1SC14H9BrN4O4c15823109(58)7(61610)14111713(20)12(19(22)23)14(21)1811h1616H(H217182021)b41+
MFCD08680782
ZINC9295529
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