Vitas-M small molecule compound
dimethyl 1-{2-[(3-methylphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
Catalog ID
STL094460
SMILES COC(=O)c1n(nnc1C(=O)OC)CC(=O)Nc1cccc(c1)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 C15H16N4O5 MW 332.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O5/c1-9-5-4-6-10(7-9)16-11(20)8-19-13(15(22)24-3)12(17-18-19)14(21)23-2/h4-7H,8H2,1-3H3,(H,16,20)InChIKey
USLKWVXYDWTAEM-UHFFFAOYSA-NSynonyms
CC1=CC(=CC=C1)NC(=O)CN2C(=C(N=N2)C(=O)OC)C(=O)OC
dimethyl1(2((3methylphenyl)amino)2oxoethyl)1H123triazole45dicarboxylate
DIMETHYL1(2(3METHYLANILINO)2OXOETHYL)TRIAZOLE45DICARBOXYLATE
InChI=1SC15H16N4O5c1954610(79)1611(20)81913(15(22)243)12(171819)14(21)232h47H8H213H3(H1620)
MFCD14749618
ZINC000000428811
ZINC428811
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