Vitas-M small molecule compound
(4E)-4-{[(2-methoxyphenyl)amino]methylidene}-5-methyl-2-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK932525
SMILES COc1ccccc1N/C=C/1\C(=NN(C1=O)c1ccc2n(n1)cnn2)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 C17H15N7O2 MW 349.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N7O2/c1-11-12(9-18-13-5-3-4-6-14(13)26-2)17(25)24(21-11)16-8-7-15-20-19-10-23(15)22-16/h3-10,18H,1-2H3/b12-9+InChIKey
VBFHGVQHILYKIE-FMIVXFBMSA-NSynonyms
(4E)4(((2methoxyphenyl)amino)methylidene)5methyl2((124)triazolo(43b)pyridazin6yl)24dihydro3Hpyrazol3one
(4E)4((2methoxyanilino)methylidene)5methyl2((124)triazolo(43b)pyridazin6yl)pyrazol3one
(E)1((124)triazolo(43b)pyridazin6yl)4(((2methoxyphenyl)amino)methylene)3methyl1Hpyrazol5(4H)one
CC1=NN(C(=O)C1=CNC2=CC=CC=C2OC)C3=NN4C=NN=C4C=C3
COc1ccccc1NC=C1C(=NN(C1=O)c1ccc2n(n1)cnn2)C
InChI=1SC17H15N7O2c11112(91813534614(13)262)17(25)24(2111)16871520191023(15)2216h31018H12H3b129+
MFCD13757017
ZINC000101641153
ZINC101641153
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