Vitas-M small molecule compound
1-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-N-(4-methoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL129738
SMILES COc1ccc(cc1)NC(=O)c1nnn(c1C)CC(=O)Nc1ccc2c(c1)OCO2
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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 C20H19N5O5 MW 409.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O5/c1-12-19(20(27)22-13-3-6-15(28-2)7-4-13)23-24-25(12)10-18(26)21-14-5-8-16-17(9-14)30-11-29-16/h3-9H,10-11H2,1-2H3,(H,21,26)(H,22,27)InChIKey
PPPXODNFOGWATP-UHFFFAOYSA-NSynonyms
1(2(13benzodioxol5ylamino)2oxoethyl)N(4methoxyphenyl)5methyl1H123triazole4carboxamide
1(2(13benzodioxol5ylamino)2oxoethyl)N(4methoxyphenyl)5methyltriazole4carboxamide
CC1=C(N=NN1CC(=O)NC2=CC3=C(C=C2)OCO3)C(=O)NC4=CC=C(C=C4)OC
InChI=1SC20H19N5O5c11219(20(27)22133615(282)7413)232425(12)1018(26)2114581617(914)30112916h39H1011H212H3(H2126)(H2227)
MFCD20747813
ZINC000067322797
ZINC67322797
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