Vitas-M small molecule compound
(4E)-4-{[(3,5-dichlorophenyl)amino]methylidene}-5-methyl-2-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK932563
SMILES Clc1cc(N/C=C/2\C(=NN(C2=O)c2ccc3n(n2)cnn3)C)cc(c1)Cl
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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 C16H11Cl2N7O MW 388.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11Cl2N7O/c1-9-13(7-19-12-5-10(17)4-11(18)6-12)16(26)25(22-9)15-3-2-14-21-20-8-24(14)23-15/h2-8,19H,1H3/b13-7+InChIKey
XSVWPIVZBULYPF-NTUHNPAUSA-NSynonyms
(4E)4(((35dichlorophenyl)amino)methylidene)5methyl2((124)triazolo(43b)pyridazin6yl)24dihydro3Hpyrazol3one
(4E)4((35dichloroanilino)methylidene)5methyl2((124)triazolo(43b)pyridazin6yl)pyrazol3one
(E)1((124)triazolo(43b)pyridazin6yl)4(((35dichlorophenyl)amino)methylene)3methyl1Hpyrazol5(4H)one
CC1=NN(C(=O)C1=CNC2=CC(=CC(=C2)Cl)Cl)C3=NN4C=NN=C4C=C3
Clc1cc(NC=C2C(=NN(C2=O)c2ccc3n(n2)cnn3)C)cc(c1)Cl
InChI=1SC16H11Cl2N7Oc1913(71912510(17)411(18)612)16(26)25(229)1532142120824(14)2315h2819H1H3b137+
MFCD13760694
ZINC000101652947
ZINC101652947
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