Vitas-M small molecule compound
5-amino-4-[hydroxy(4-nitrophenyl)methyl]-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK333406
SMILES OC(c1c(N)[nH]n(c1=O)c1ccccc1)c1ccc(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 C16H14N4O4 MW 326.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O4/c17-15-13(14(21)10-6-8-12(9-7-10)20(23)24)16(22)19(18-15)11-4-2-1-3-5-11/h1-9,14,18,21H,17H2InChIKey
TWYHGUZZHINWIJ-UHFFFAOYSA-NSynonyms
951923-41-45amino4(hydroxy(4nitrophenyl)methyl)2phenyl12dihydro3Hpyrazol3one
5amino4(hydroxy(4nitrophenyl)methyl)2phenyl1Hpyrazol3one
951923414
C1=CC=C(C=C1)N2C(=O)C(=C(N2)N)C(C3=CC=C(C=C3)(N+)(=O)(O))O
InChI=1SC16H14N4O4c171513(14(21)106812(9710)20(23)24)16(22)19(1815)114213511h19141821H17H2
MFCD09963033
OC(c1c(N)(nH)n(c1=O)c1ccccc1)c1ccc(cc1)(N+)(=O)(O)
ZINC000101034067
ZINC000101034069
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