Vitas-M small molecule compound
(4E)-5-methyl-2-(2-methylphenyl)-4-{[(2-nitrophenyl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK750451
SMILES CC1=NN(C(=O)/C/1=C/Nc1ccccc1[N+](=O)[O-])c1ccccc1C
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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 C18H16N4O3 MW 336.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O3/c1-12-7-3-5-9-16(12)21-18(23)14(13(2)20-21)11-19-15-8-4-6-10-17(15)22(24)25/h3-11,19H,1-2H3/b14-11+InChIKey
SHAJLQUDPFZDQT-SDNWHVSQSA-NSynonyms
(4E)5methyl2(2methylphenyl)4(((2nitrophenyl)amino)methylidene)24dihydro3Hpyrazol3one
(4E)5METHYL2(2METHYLPHENYL)4((2NITROANILINO)METHYLIDENE)PYRAZOL3ONE
CC1=CC=CC=C1N2C(=O)C(=CNC3=CC=CC=C3(N+)(=O)(O))C(=N2)C
CC1=NN(C(=O)C1=CNc1ccccc1(N+)(=O)(O))c1ccccc1C
InChI=1SC18H16N4O3c112735916(12)2118(23)14(13(2)2021)1119158461017(15)22(24)25h31119H12H3b1411+
MFCD00697258
ZINC000100984886
ZINC100984886
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