Vitas-M small molecule compound
(4E)-4-{[(3-chloro-4-fluorophenyl)amino]methylidene}-5-methyl-2-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK931537
SMILES CC1=NN(C(=O)/C/1=C/Nc1ccc(c(c1)Cl)F)c1ccc2n(n1)cnn2
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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 C16H11ClFN7O MW 371.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClFN7O/c1-9-11(7-19-10-2-3-13(18)12(17)6-10)16(26)25(22-9)15-5-4-14-21-20-8-24(14)23-15/h2-8,19H,1H3/b11-7+InChIKey
WHLNHPUQHYLIPF-YRNVUSSQSA-NSynonyms
(4E)4(((3chloro4fluorophenyl)amino)methylidene)5methyl2((124)triazolo(43b)pyridazin6yl)24dihydro3Hpyrazol3one
(4E)4((3chloro4fluoroanilino)methylidene)5methyl2((124)triazolo(43b)pyridazin6yl)pyrazol3one
(E)1((124)triazolo(43b)pyridazin6yl)4(((3chloro4fluorophenyl)amino)methylene)3methyl1Hpyrazol5(4H)one
CC1=NN(C(=O)C1=CNc1ccc(c(c1)Cl)F)c1ccc2n(n1)cnn2
CC1=NN(C(=O)C1=CNC2=CC(=C(C=C2)F)Cl)C3=NN4C=NN=C4C=C3
InChI=1SC16H11ClFN7Oc1911(719102313(18)12(17)610)16(26)25(229)1554142120824(14)2315h2819H1H3b117+
MFCD13760281
ZINC000101651473
ZINC101651473
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