Vitas-M small molecule compound
3-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-6-(3,4-dimethoxybenzyl)-1,2,4-triazin-5(2H)-one
Catalog ID
STK700062
SMILES COc1cc(ccc1OC)Cc1n[nH]c(nc1=O)N/N=C/c1ccc(cc1)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 C19H18BrN5O3 MW 444.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrN5O3/c1-27-16-8-5-13(10-17(16)28-2)9-15-18(26)22-19(25-23-15)24-21-11-12-3-6-14(20)7-4-12/h3-8,10-11H,9H2,1-2H3,(H2,22,24,25,26)/b21-11+InChIKey
PLGVUVLEIQUTQE-SRZZPIQSSA-NSynonyms
351980-65-9(E)3(2(4bromobenzylidene)hydrazinyl)6(34dimethoxybenzyl)124triazin5(2H)one
3((2E)2((4bromophenyl)methylidene)hydrazinyl)6((34dimethoxyphenyl)methyl)2H124triazin5one
3((2E)2(4bromobenzylidene)hydrazinyl)6(34dimethoxybenzyl)124triazin5(2H)one
3(N(1(4BROMOPHENYL)METH(E)YLIDENE)HYDRAZINO)6(34DIMETHOXYBENZYL)2H(124)TRIAZIN5ONE
351980659
COC1=C(C=C(C=C1)CC2=NNC(=NC2=O)NN=CC3=CC=C(C=C3)Br)OC
COc1cc(ccc1OC)Cc1n(nH)c(nc1=O)NN=Cc1ccc(cc1)Br
InChI=1SC19H18BrN5O3c127168513(1017(16)282)91518(26)2219(252315)242111123614(20)7412h381011H9H212H3(H222242526)b2111+
MFCD00717298
ZINC000013638722
ZINC59729027
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