Vitas-M small molecule compound
(3E)-3-[({[3-(methoxymethyl)-1H-1,2,4-triazol-5-yl](phenyl)methyl}amino)methylidene]-2H-chromene-2,4(3H)-dione
Catalog ID
STL510202
SMILES COCc1n[nH]c(n1)C(c1ccccc1)N/C=C\1/C(=O)Oc2c(C1=O)cccc2
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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 C21H18N4O4 MW 390.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O4/c1-28-12-17-23-20(25-24-17)18(13-7-3-2-4-8-13)22-11-15-19(26)14-9-5-6-10-16(14)29-21(15)27/h2-11,18,22H,12H2,1H3,(H,23,24,25)/b15-11+InChIKey
XOGSHZTZQKEZGP-RVDMUPIBSA-NSynonyms
(3E)3((((3(methoxymethyl)1H124triazol5yl)(phenyl)methyl)amino)methylidene)2Hchromene24(3H)dione
(E)3((((5(methoxymethyl)1H124triazol3yl)(phenyl)methyl)amino)methylene)chroman24dione
COCc1(nH)nc(n1)C(c1ccccc1)NC=C1C(=O)Oc2c(C1=O)cccc2
InChI=1SC21H18N4O4c12812172320(252417)18(137324813)22111519(26)149561016(14)2921(15)27h2111822H12H21H3(H232425)b1511+
MFCD31711298
ZINC000824475391
ZINC000824475392
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