Vitas-M small molecule compound

(4Z)-2-(4-fluorophenyl)-5-methyl-4-{[(4-nitrophenyl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STL175367
SMILES Fc1ccc(cc1)N1N=C(/C(=C/Nc2ccc(cc2)[N+](=O)[O-])/C1=O)C

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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 C17H13FN4O3 MW 340.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13FN4O3/c1-11-16(10-19-13-4-8-15(9-5-13)22(24)25)17(23)21(20-11)14-6-2-12(18)3-7-14/h2-10,19H,1H3/b16-10-
InChIKey
TXWKQGYAZQJCPO-YBEGLDIGSA-N
Synonyms
352700-88-0
(4Z)2(4fluorophenyl)5methyl4(((4nitrophenyl)amino)methylidene)24dihydro3Hpyrazol3one
(4Z)2(4FLUOROPHENYL)5METHYL4((4NITROANILINO)METHYLIDENE)PYRAZOL3ONE
352700880
CC1=NN(C(=O)C1=CNC2=CC=C(C=C2)(N+)(=O)(O))C3=CC=C(C=C3)F
Fc1ccc(cc1)N1N=C(C(=CNc2ccc(cc2)(N+)(=O)(O))C1=O)C
InChI=1SC17H13FN4O3c11116(1019134815(9513)22(24)25)17(23)21(2011)146212(18)3714h21019H1H3b1610
MFCD01648005
ZINC000015930673
ZINC15930673

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Available files

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