Vitas-M small molecule compound
N'-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-[3-cyano-4-(methoxymethyl)-6-methyl-2-oxopyridin-1(2H)-yl]acetohydrazide
Catalog ID
STL383070
SMILES COCc1cc(C)n(c(=O)c1C#N)CC(=O)N/N=C/c1cc2OCOc2cc1Br
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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 C19H17BrN4O5 MW 461.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17BrN4O5/c1-11-3-13(9-27-2)14(6-21)19(26)24(11)8-18(25)23-22-7-12-4-16-17(5-15(12)20)29-10-28-16/h3-5,7H,8-10H2,1-2H3,(H,23,25)/b22-7+InChIKey
IJZBQFQTLCFGLJ-QPJQQBGISA-NSynonyms
CC1=CC(=C(C(=O)N1CC(=O)NN=CC2=CC3=C(C=C2Br)OCO3)C#N)COC
COCc1cc(C)n(c(=O)c1C#N)CC(=O)NN=Cc1cc2OCOc2cc1Br
InChI=1SC19H17BrN4O5c111313(9272)14(621)19(26)24(11)818(25)232271241617(515(12)20)29102816h357H810H212H3(H2325)b227+
MFCD28952488
N((E)(6bromo13benzodioxol5yl)methylidene)2(3cyano4(methoxymethyl)6methyl2oxopyridin1(2H)yl)acetohydrazide
N((E)(6bromo13benzodioxol5yl)methylideneamino)2(3cyano4(methoxymethyl)6methyl2oxopyridin1yl)acetamide
ZINC000098087081
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