Vitas-M small molecule compound

(2E)-3-{5-[(5-fluoro-2-nitrophenoxy)methyl]furan-2-yl}-1-(1-methyl-1H-pyrazol-5-yl)prop-2-en-1-one

Catalog ID
STL390563
SMILES Fc1ccc(c(c1)OCc1ccc(o1)/C=C/C(=O)c1ccnn1C)[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 C18H14FN3O5 MW 371.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14FN3O5/c1-21-15(8-9-20-21)17(23)7-5-13-3-4-14(27-13)11-26-18-10-12(19)2-6-16(18)22(24)25/h2-10H,11H2,1H3/b7-5+
InChIKey
LHBQAZAFCQLGAP-FNORWQNLSA-N
Synonyms
1005656-67-6
(2E)3(5((5fluoro2nitrophenoxy)methyl)furan2yl)1(1methyl1Hpyrazol5yl)prop2en1one
(E)3(5((5fluoro2nitrophenoxy)methyl)furan2yl)1(2methylpyrazol3yl)prop2en1one
1005656676
CN1C(=CC=N1)C(=O)C=CC2=CC=C(O2)COC3=C(C=CC(=C3)F)(N+)(=O)(O)
Fc1ccc(c(c1)OCc1ccc(o1)C=CC(=O)c1ccnn1C)(N+)(=O)(O)
InChI=1SC18H14FN3O5c12115(892021)17(23)75133414(2713)1126181012(19)2616(18)22(24)25h210H11H21H3b75+
MFCD04135829
ZINC000006925473
ZINC06925473
ZINC6925473

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Available files

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