Vitas-M small molecule compound

2-[3-cyano-4-(methoxymethyl)-6-methyl-2-oxopyridin-1(2H)-yl]-N'-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]acetohydrazide

Catalog ID
STL026288
SMILES COCc1cc(C)n(c(=O)c1C#N)CC(=O)N/N=C/c1cc2OCOc2cc1[N+](=O)[O-]

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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 C19H17N5O7 MW 427.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O7/c1-11-3-13(9-29-2)14(6-20)19(26)23(11)8-18(25)22-21-7-12-4-16-17(31-10-30-16)5-15(12)24(27)28/h3-5,7H,8-10H2,1-2H3,(H,22,25)/b21-7+
InChIKey
IQAORRXKJJZLNU-QPSGOUHRSA-N
Synonyms
384352-36-7
(E)2(3cyano4(methoxymethyl)6methyl2oxopyridin1(2H)yl)N((6nitrobenzo(d)(13)dioxol5yl)methylene)acetohydrazide
2(3cyano4(methoxymethyl)6methyl2oxopyridin1(2H)yl)N((E)(6nitro13benzodioxol5yl)methylidene)acetohydrazide
2(3CYANO4(METHOXYMETHYL)6METHYL2OXOPYRIDIN1YL)N((E)(6NITRO13BENZODIOXOL5YL)METHYLIDENEAMINO)ACETAMIDE
384352367
CC1=CC(=C(C(=O)N1CC(=O)NN=CC2=CC3=C(C=C2(N+)(=O)(O))OCO3)C#N)COC
COCc1cc(C)n(c(=O)c1C#N)CC(=O)NN=Cc1cc2OCOc2cc1(N+)(=O)(O)
InChI=1SC19H17N5O7c111313(9292)14(620)19(26)23(11)818(25)222171241617(31103016)515(12)24(27)28h357H810H212H3(H2225)b217+
MFCD03160337
ZINC000001870110
ZINC33345667

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Available files

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