Vitas-M small molecule compound
2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-[(E)-(4-nitrophenyl)methylidene]acetohydrazide (non-preferred name)
Catalog ID
STL320893
SMILES O=C(N/N=C/c1ccc(cc1)[N+](=O)[O-])CC1NC(=NNC1=O)Cc1ccccc1
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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 C19H18N6O4 MW 394.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N6O4/c26-18(23-20-12-14-6-8-15(9-7-14)25(28)29)11-16-19(27)24-22-17(21-16)10-13-4-2-1-3-5-13/h1-9,12,16H,10-11H2,(H,21,22)(H,23,26)(H,24,27)/b20-12+InChIKey
GCBAOYXQHLMONL-UDWIEESQSA-NSynonyms
(E)2(3benzyl6oxo1456tetrahydro124triazin5yl)N(4nitrobenzylidene)acetohydrazide
2(3benzyl6oxo1456tetrahydro124triazin5yl)N((E)(4nitrophenyl)methylidene)acetohydrazide(nonpreferredname)
2(3benzyl6oxo25dihydro1H124triazin5yl)N((E)(4nitrophenyl)methylideneamino)acetamide
C1=CC=C(C=C1)CC2=NC(C(=O)NN2)CC(=O)NN=CC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC19H18N6O4c2618(232012146815(9714)25(28)29)111619(27)242217(2116)10134213513h191216H1011H2(H2122)(H2326)(H2427)b2012+
MFCD00346138
O=C(NN=Cc1ccc(cc1)(N+)(=O)(O))CC1NC(=NNC1=O)Cc1ccccc1
ZINC000009008231
ZINC000017138097
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