Vitas-M small molecule compound

2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-[(E)-(3-phenoxyphenyl)methylidene]acetohydrazide (non-preferred name)

Catalog ID
STK529675
SMILES O=C(CC1NC(=NNC1=O)Cc1ccccc1)N/N=C/c1cccc(c1)Oc1ccccc1

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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 C25H23N5O3 MW 441.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O3/c31-24(16-22-25(32)30-28-23(27-22)15-18-8-3-1-4-9-18)29-26-17-19-10-7-13-21(14-19)33-20-11-5-2-6-12-20/h1-14,17,22H,15-16H2,(H,27,28)(H,29,31)(H,30,32)/b26-17+
InChIKey
VWRAJQKYRJVYLM-YZSQISJMSA-N
Synonyms

(E)2(3benzyl6oxo1456tetrahydro124triazin5yl)N(3phenoxybenzylidene)acetohydrazide
2(3benzyl6oxo1456tetrahydro124triazin5yl)N((E)(3phenoxyphenyl)methylidene)acetohydrazide(nonpreferredname)
2(3benzyl6oxo25dihydro1H124triazin5yl)N((E)(3phenoxyphenyl)methylideneamino)acetamide
C1=CC=C(C=C1)CC2=NC(C(=O)NN2)CC(=O)NN=CC3=CC(=CC=C3)OC4=CC=CC=C4
InChI=1SC25H23N5O3c3124(162225(32)302823(2722)15188314918)292617191071321(1419)3320115261220h1141722H1516H2(H2728)(H2931)(H3032)b2617+
MFCD00328357
O=C(CC1NC(=NNC1=O)Cc1ccccc1)NN=Cc1cccc(c1)Oc1ccccc1
ZINC000000973013
ZINC000000973015

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Available files

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