Vitas-M small molecule compound

6-(3,4-dimethoxybenzyl)-3-{(2E)-2-[4-(dimethylamino)benzylidene]hydrazinyl}-1,2,4-triazin-5(2H)-one

Catalog ID
STK806332
SMILES COc1ccc(cc1OC)Cc1n[nH]c(nc1=O)N/N=C/c1ccc(cc1)N(C)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 C21H24N6O3 MW 408.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N6O3/c1-27(2)16-8-5-14(6-9-16)13-22-25-21-23-20(28)17(24-26-21)11-15-7-10-18(29-3)19(12-15)30-4/h5-10,12-13H,11H2,1-4H3,(H2,23,25,26,28)/b22-13+
InChIKey
ISHRDMBEQOQSON-LPYMAVHISA-N
Synonyms
131468-58-1
(E)6(34dimethoxybenzyl)3(2(4(dimethylamino)benzylidene)hydrazinyl)124triazin5(2H)one
131468581
6((34dimethoxyphenyl)methyl)3((2E)2((4(dimethylamino)phenyl)methylidene)hydrazinyl)2H124triazin5one
6(34dimethoxybenzyl)3((2E)2(4(dimethylamino)benzylidene)hydrazinyl)124triazin5(2H)one
6(34DIMETHOXYBENZYL)3(N(1(4DIMETHYLAMINOPHENYL)METH(E)YLIDENE)HYDRAZINO)2H(124)TRIAZIN5ONE
CN(C)C1=CC=C(C=C1)C=NNC2=NC(=O)C(=NN2)CC3=CC(=C(C=C3)OC)OC
COc1ccc(cc1OC)Cc1n(nH)c(nc1=O)NN=Cc1ccc(cc1)N(C)C
InChI=1SC21H24N6O3c127(2)168514(6916)132225212320(28)17(242621)111571018(293)19(1215)304h5101213H11H214H3(H223252628)b2213+
MFCD00717300
ZINC000018213141
ZINC38206605

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Available files

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