Vitas-M small molecule compound

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

Catalog ID
STK741956
SMILES Fc1cccc(c1)N/C=C/1\C(=O)N(N=C1C(F)(F)F)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 C17H10F4N4O3 MW 394.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H10F4N4O3/c18-10-2-1-3-11(8-10)22-9-14-15(17(19,20)21)23-24(16(14)26)12-4-6-13(7-5-12)25(27)28/h1-9,22H/b14-9-
InChIKey
GNKGXLMEMWQTLO-ZROIWOOFSA-N
Synonyms

(4Z)4(((3fluorophenyl)amino)methylidene)2(4nitrophenyl)5(trifluoromethyl)24dihydro3Hpyrazol3one
(4Z)4((3FLUOROANILINO)METHYLIDENE)2(4NITROPHENYL)5(TRIFLUOROMETHYL)PYRAZOL3ONE
4((3FLUOROANILINO)METHYLENE)2(4NITROPHENYL)5(TRIFLUOROMETHYL)24DIHYDRO3HPYRAZOL3ONE
C1=CC(=CC(=C1)F)NC=C2C(=NN(C2=O)C3=CC=C(C=C3)(N+)(=O)(O))C(F)(F)F
Fc1cccc(c1)NC=C1C(=O)N(N=C1C(F)(F)F)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC17H10F4N4O3c181021311(810)2291415(17(1920)21)2324(16(14)26)124613(7512)25(27)28h1922Hb149
MFCD01113821
ZINC000100057188
ZINC100057188

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Available files

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