Vitas-M small molecule compound
N'-[(1E,2Z)-2-bromo-3-phenylprop-2-en-1-ylidene]-3-(4-methoxyphenyl)-4-methyl-1H-pyrazole-5-carbohydrazide
Catalog ID
STK395342
SMILES COc1ccc(cc1)c1n[nH]c(c1C)C(=O)N/N=C/C(=C/c1ccccc1)/Br
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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 C21H19BrN4O2 MW 439.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN4O2/c1-14-19(16-8-10-18(28-2)11-9-16)24-25-20(14)21(27)26-23-13-17(22)12-15-6-4-3-5-7-15/h3-13H,1-2H3,(H,24,25)(H,26,27)/b17-12-,23-13+InChIKey
TYAOVDKJGZQKHD-BZGQBJAUSA-NSynonyms
CC1=C(NN=C1C2=CC=C(C=C2)OC)C(=O)NN=CC(=CC3=CC=CC=C3)Br
COc1ccc(cc1)c1n(nH)c(c1C)C(=O)NN=CC(=Cc1ccccc1)Br
InChI=1SC21H19BrN4O2c11419(1681018(282)11916)242520(14)21(27)26231317(22)12156435715h313H12H3(H2425)(H2627)b17122313+
MFCD01915554
N((1E2Z)2bromo3phenylprop2en1ylidene)3(4methoxyphenyl)4methyl1Hpyrazole5carbohydrazide
N((3Z1E)3BROMO4PHENYL1AZABUTA13DIENYL)(3(4METHOXYPHENYL)4METHYLPYRAZOL5YL)CARBOXAMIDE
N((E)((Z)2bromo3phenylprop2enylidene)amino)3(4methoxyphenyl)4methyl1Hpyrazole5carboxamide
ZINC000004112972
ZINC38205600
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