Vitas-M small molecule compound

(3E)-3-[({3-[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]phenyl}amino)methylidene]-6-methyl-2H-pyran-2,4(3H)-dione

Catalog ID
STL509840
SMILES COCc1[nH]nc(n1)c1cccc(c1)N/C=C\1/C(=O)OC(=CC1=O)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 C17H16N4O4 MW 340.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O4/c1-10-6-14(22)13(17(23)25-10)8-18-12-5-3-4-11(7-12)16-19-15(9-24-2)20-21-16/h3-8,18H,9H2,1-2H3,(H,19,20,21)/b13-8+
InChIKey
IEKRIPNYJFGEGV-MDWZMJQESA-N
Synonyms

(3E)3(((3(5(methoxymethyl)1H124triazol3yl)phenyl)amino)methylidene)6methyl2Hpyran24(3H)dione
(E)3(((3(3(methoxymethyl)1H124triazol5yl)phenyl)amino)methylene)6methyl2Hpyran24(3H)dione
COCc1n(nH)c(n1)c1cccc(c1)NC=C1C(=O)OC(=CC1=O)C
InChI=1SC17H16N4O4c110614(22)13(17(23)2510)8181253411(712)161915(9242)202116h3818H9H212H3(H192021)b138+
MFCD31710957
ZINC001547200813

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Available files

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