Vitas-M small molecule compound

6-(3,4-dimethoxybenzyl)-3-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-1,2,4-triazin-5(2H)-one

Catalog ID
STK806331
SMILES COc1ccc(cc1)/C=N/Nc1[nH]nc(c(=O)n1)Cc1ccc(c(c1)OC)OC

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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 C20H21N5O4 MW 395.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O4/c1-27-15-7-4-13(5-8-15)12-21-24-20-22-19(26)16(23-25-20)10-14-6-9-17(28-2)18(11-14)29-3/h4-9,11-12H,10H2,1-3H3,(H2,22,24,25,26)/b21-12+
InChIKey
CIFACZCOCKENMB-CIAFOILYSA-N
Synonyms

(E)6(34dimethoxybenzyl)3(2(4methoxybenzylidene)hydrazinyl)124triazin5(2H)one
6((34dimethoxyphenyl)methyl)3((2E)2((4methoxyphenyl)methylidene)hydrazinyl)2H124triazin5one
6(34dimethoxybenzyl)3((2E)2(4methoxybenzylidene)hydrazinyl)124triazin5(2H)one
6(34DIMETHOXYBENZYL)3(N(1(4METHOXYPHENYL)METH(E)YLIDENE)HYDRAZINO)2H(124)TRIAZIN5ONE
COC1=CC=C(C=C1)C=NNC2=NC(=O)C(=NN2)CC3=CC(=C(C=C3)OC)OC
COc1ccc(cc1)C=NNc1(nH)nc(c(=O)n1)Cc1ccc(c(c1)OC)OC
InChI=1SC20H21N5O4c127157413(5815)122124202219(26)16(232520)10146917(282)18(1114)293h491112H10H213H3(H222242526)b2112+
MFCD00717299
ZINC000008830074
ZINC35225658

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Available files

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