Vitas-M small molecule compound
(4Z)-2-(4-nitrophenyl)-4-{[(4-nitrophenyl)amino]methylidene}-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK741700
SMILES [O-][N+](=O)c1ccc(cc1)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 C17H10F3N5O5 MW 421.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H10F3N5O5/c18-17(19,20)15-14(9-21-10-1-3-12(4-2-10)24(27)28)16(26)23(22-15)11-5-7-13(8-6-11)25(29)30/h1-9,21H/b14-9-InChIKey
DAKMILXMWHVWTE-ZROIWOOFSA-NSynonyms
(4Z)2(4nitrophenyl)4(((4nitrophenyl)amino)methylidene)5(trifluoromethyl)24dihydro3Hpyrazol3one
(4Z)4((4NITROANILINO)METHYLIDENE)2(4NITROPHENYL)5(TRIFLUOROMETHYL)PYRAZOL3ONE
(O)(N+)(=O)c1ccc(cc1)NC=C1C(=O)N(N=C1C(F)(F)F)c1ccc(cc1)(N+)(=O)(O)
C1=CC(=CC=C1NC=C2C(=NN(C2=O)C3=CC=C(C=C3)(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
InChI=1SC17H10F3N5O5c1817(1920)1514(921101312(4210)24(27)28)16(26)23(2215)115713(8611)25(29)30h1921Hb149
MFCD01113820
ZINC000100057186
ZINC100057186
Check stock
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Check stock on Vitas-MAvailable files
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