Vitas-M small molecule compound
(4E)-5-methyl-4-{2-[2-(morpholin-4-ylcarbonyl)phenyl]hydrazinylidene}-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK061968
SMILES CC1=NN(C(=O)/C/1=N/Nc1ccccc1C(=O)N1CCOCC1)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 C21H20N6O5 MW 436.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O5/c1-14-19(21(29)26(24-14)15-6-8-16(9-7-15)27(30)31)23-22-18-5-3-2-4-17(18)20(28)25-10-12-32-13-11-25/h2-9,22H,10-13H2,1H3/b23-19+InChIKey
LJBAANIZQDFYPB-FCDQGJHFSA-NSynonyms
(4E)5methyl4((2(morpholine4carbonyl)phenyl)hydrazinylidene)2(4nitrophenyl)pyrazol3one
(4E)5METHYL4(2(2(MORPHOLIN4YLCARBONYL)PHENYL)HYDRAZINYLIDENE)2(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
CC1=NN(C(=O)C1=NNc1ccccc1C(=O)N1CCOCC1)c1ccc(cc1)(N+)(=O)(O)
CC1=NN(C(=O)C1=NNC2=CC=CC=C2C(=O)N3CCOCC3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC21H20N6O5c11419(21(29)26(2414)156816(9715)27(30)31)232218532417(18)20(28)25101232131125h2922H1013H21H3b2319+
MFCD01418887
STK061968
ZINC000013896996
ZINC96570041
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