Vitas-M small molecule compound

methyl 5-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-1H-1,2,3-triazole-4-carboxylate

Catalog ID
STL434702
SMILES COc1ccc(cc1)c1c(nnn1c1cc(OC)c(c(c1)OC)OC)C(=O)OC

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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 C20H21N3O6 MW 399.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O6/c1-25-14-8-6-12(7-9-14)18-17(20(24)29-5)21-22-23(18)13-10-15(26-2)19(28-4)16(11-13)27-3/h6-11H,1-5H3
InChIKey
PLIMGILENGQOOC-UHFFFAOYSA-N
Synonyms

COC1=CC=C(C=C1)C2=C(N=NN2C3=CC(=C(C(=C3)OC)OC)OC)C(=O)OC
InChI=1SC20H21N3O6c125148612(7914)1817(20(24)295)212223(18)131015(262)19(284)16(1113)273h611H15H3
methyl5(4methoxyphenyl)1(345trimethoxyphenyl)1H123triazole4carboxylate
methyl5(4methoxyphenyl)1(345trimethoxyphenyl)triazole4carboxylate
MFCD30711335
ZINC000096336477
ZINC96336477

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.