Vitas-M small molecule compound
(2E)-1-(1,3-dimethyl-1H-pyrazol-5-yl)-3-{5-[(4-nitrophenoxy)methyl]furan-2-yl}prop-2-en-1-one
Catalog ID
STL392615
SMILES O=C(c1cc(nn1C)C)/C=C/c1ccc(o1)COc1ccc(cc1)[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 C19H17N3O5 MW 367.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O5/c1-13-11-18(21(2)20-13)19(23)10-9-16-7-8-17(27-16)12-26-15-5-3-14(4-6-15)22(24)25/h3-11H,12H2,1-2H3/b10-9+InChIKey
NULJDSVSCDPZGV-MDZDMXLPSA-NSynonyms
1005602-45-8(2E)1(13dimethyl1Hpyrazol5yl)3(5((4nitrophenoxy)methyl)furan2yl)prop2en1one
(E)1(25DIMETHYLPYRAZOL3YL)3(5((4NITROPHENOXY)METHYL)FURAN2YL)PROP2EN1ONE
1005602458
CC1=NN(C(=C1)C(=O)C=CC2=CC=C(O2)COC3=CC=C(C=C3)(N+)(=O)(O))C
InChI=1SC19H17N3O5c1131118(21(2)2013)19(23)109167817(2716)1226155314(4615)22(24)25h311H12H212H3b109+
MFCD04052791
O=C(c1cc(nn1C)C)C=Cc1ccc(o1)COc1ccc(cc1)(N+)(=O)(O)
ZINC000006527841
ZINC06527841
ZINC6527841
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