Vitas-M small molecule compound
(3E)-3-[({3-[5-(1H-1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazol-3-yl]phenyl}amino)methylidene]-2H-chromene-2,4(3H)-dione
Catalog ID
STL568516
SMILES O=C1Oc2ccccc2C(=O)/C/1=C\Nc1cccc(c1)c1n[nH]c(n1)Cn1ncnc1
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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 C21H15N7O3 MW 413.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N7O3/c29-19-15-6-1-2-7-17(15)31-21(30)16(19)9-23-14-5-3-4-13(8-14)20-25-18(26-27-20)10-28-12-22-11-24-28/h1-9,11-12,23H,10H2,(H,25,26,27)/b16-9+InChIKey
NEVDGKAAPOTNPS-CXUHLZMHSA-NSynonyms
(3E)3(((3(5(1H124triazol1ylmethyl)1H124triazol3yl)phenyl)amino)methylidene)2Hchromene24(3H)dione
(E)3(((3(3((1H124triazol1yl)methyl)1H124triazol5yl)phenyl)amino)methylene)chroman24dione
MFCD32653601
O=C1Oc2ccccc2C(=O)C1=CNc1cccc(c1)c1(nH)nc(n1)Cn1ncnc1
ZINC000828327288
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