Vitas-M small molecule compound
(4Z)-5-methyl-4-({5-[3-nitro-4-(piperidin-1-yl)phenyl]furan-2-yl}methylidene)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK868945
SMILES CC1=NN(C(=O)/C/1=C\c1ccc(o1)c1ccc(c(c1)[N+](=O)[O-])N1CCCCC1)c1ccccc1
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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 C26H24N4O4 MW 456.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4O4/c1-18-22(26(31)29(27-18)20-8-4-2-5-9-20)17-21-11-13-25(34-21)19-10-12-23(24(16-19)30(32)33)28-14-6-3-7-15-28/h2,4-5,8-13,16-17H,3,6-7,14-15H2,1H3/b22-17-InChIKey
WVPHCSDYFGBOED-XLNRJJMWSA-NSynonyms
(4Z)5methyl4((5(3nitro4(piperidin1yl)phenyl)furan2yl)methylidene)2phenyl24dihydro3Hpyrazol3one
(4Z)5METHYL4((5(3NITRO4PIPERIDIN1YLPHENYL)FURAN2YL)METHYLIDENE)2PHENYLPYRAZOL3ONE
(E)3methyl4((5(3nitro4(piperidin1yl)phenyl)furan2yl)methylene)1phenyl1Hpyrazol5(4H)one
CC1=NN(C(=O)C1=Cc1ccc(o1)c1ccc(c(c1)(N+)(=O)(O))N1CCCCC1)c1ccccc1
CC1=NN(C(=O)C1=CC2=CC=C(O2)C3=CC(=C(C=C3)N4CCCCC4)(N+)(=O)(O))C5=CC=CC=C5
InChI=1SC26H24N4O4c11822(26(31)29(2718)208425920)1721111325(3421)19101223(24(1619)30(32)33)28146371528h2458131617H3671415H21H3b2217
MFCD03715293
ZINC000013751438
ZINC13751438
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