Vitas-M small molecule compound
2-[(2,3-dimethylphenoxy)methyl]-12-phenyl-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3-ium-9-olate
Catalog ID
STL053720
SMILES [O-]c1ccc2c(c1)Oc1c(C2c2ccccc2)c2nc([nH+]n2cn1)COc1cccc(c1C)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 C27H22N4O3 MW 450.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N4O3/c1-16-7-6-10-21(17(16)2)33-14-23-29-26-25-24(18-8-4-3-5-9-18)20-12-11-19(32)13-22(20)34-27(25)28-15-31(26)30-23/h3-13,15,24,32H,14H2,1-2H3InChIKey
HHJPPVXJGVRSCZ-UHFFFAOYSA-NSynonyms
844653-09-4(O)c1ccc2c(c1)Oc1c(C2c2ccccc2)c2nc((nH+)n2cn1)COc1cccc(c1C)C
2((23dimethylphenoxy)methyl)12phenyl12Hchromeno(32e)(124)triazolo(15c)pyrimidin3ium9olate
844653094
MFCD04159263
ZINC000009215905
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