Vitas-M small molecule compound
dimethyl 1-[2-(4-methylphenyl)-2-oxoethyl]-1H-1,2,3-triazole-4,5-dicarboxylate
Catalog ID
STL094365
SMILES COC(=O)c1n(nnc1C(=O)OC)CC(=O)c1ccc(cc1)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 C15H15N3O5 MW 317.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3O5/c1-9-4-6-10(7-5-9)11(19)8-18-13(15(21)23-3)12(16-17-18)14(20)22-2/h4-7H,8H2,1-3H3InChIKey
TWLYHIFTNYQJMU-UHFFFAOYSA-NSynonyms
1291852-40-81291852408
CC1=CC=C(C=C1)C(=O)CN2C(=C(N=N2)C(=O)OC)C(=O)OC
dimethyl1(2(4methylphenyl)2oxoethyl)1H123triazole45dicarboxylate
dimethyl1(2(4methylphenyl)2oxoethyl)triazole45dicarboxylate
InChI=1SC15H15N3O5c194610(759)11(19)81813(15(21)233)12(161718)14(20)222h47H8H213H3
MFCD18788134
ZINC000067240426
ZINC67240426
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