Vitas-M small molecule compound
(2E)-3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-2-nitro-1-phenylprop-2-en-1-one
Catalog ID
STL392786
SMILES CCn1ncc(c1C)/C=C(\C(=O)c1ccccc1)/[N+](=O)[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 C15H15N3O3 MW 285.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3O3/c1-3-17-11(2)13(10-16-17)9-14(18(20)21)15(19)12-7-5-4-6-8-12/h4-10H,3H2,1-2H3/b14-9+InChIKey
YPDOEJTWQUEYHN-NTEUORMPSA-NSynonyms
1005632-27-8(2E)3(1ethyl5methyl1Hpyrazol4yl)2nitro1phenylprop2en1one
(E)3(1ethyl5methylpyrazol4yl)2nitro1phenylprop2en1one
1005632278
CCN1C(=C(C=N1)C=C(C(=O)C2=CC=CC=C2)(N+)(=O)(O))C
CCn1ncc(c1C)C=C(C(=O)c1ccccc1)(N+)(=O)(O)
InChI=1SC15H15N3O3c131711(2)13(101617)914(18(20)21)15(19)127546812h410H3H212H3b149+
MFCD04046871
ZINC000006490019
ZINC06490019
ZINC6490019
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