Vitas-M small molecule compound
methyl 3,4,5-trimethoxy-2-{[(5-methyl-2-phenyl-2H-1,2,3-triazol-4-yl)carbonyl]amino}benzoate
Catalog ID
STK666635
SMILES COC(=O)c1cc(OC)c(c(c1NC(=O)c1nn(nc1C)c1ccccc1)OC)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 C21H22N4O6 MW 426.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O6/c1-12-16(24-25(23-12)13-9-7-6-8-10-13)20(26)22-17-14(21(27)31-5)11-15(28-2)18(29-3)19(17)30-4/h6-11H,1-5H3,(H,22,26)InChIKey
WGEJVLARIJEORY-UHFFFAOYSA-NSynonyms
CC1=NN(N=C1C(=O)NC2=C(C(=C(C=C2C(=O)OC)OC)OC)OC)C3=CC=CC=C3
InChI=1SC21H22N4O6c11216(2425(2312)1397681013)20(26)221714(21(27)315)1115(282)18(293)19(17)304h611H15H3(H2226)
methyl345trimethoxy2(((5methyl2phenyl2H123triazol4yl)carbonyl)amino)benzoate
methyl345trimethoxy2((5methyl2phenyltriazole4carbonyl)amino)benzoate
MFCD10038588
ZINC000015084132
ZINC15084132
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