Vitas-M small molecule compound
1-(3-chloro-4-methylphenyl)-N-(3-ethoxy-4-methoxybenzyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STK986636
SMILES CCOc1cc(CNC(=O)c2nnn(c2C)c2ccc(c(c2)Cl)C)ccc1OC
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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 C21H23ClN4O3 MW 414.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN4O3/c1-5-29-19-10-15(7-9-18(19)28-4)12-23-21(27)20-14(3)26(25-24-20)16-8-6-13(2)17(22)11-16/h6-11H,5,12H2,1-4H3,(H,23,27)InChIKey
AGPOFLQPOMDPIN-UHFFFAOYSA-NSynonyms
1(3chloro4methylphenyl)N((3ethoxy4methoxyphenyl)methyl)5methyltriazole4carboxamide
1(3chloro4methylphenyl)N(3ethoxy4methoxybenzyl)5methyl1H123triazole4carboxamide
CCOC1=C(C=CC(=C1)CNC(=O)C2=C(N(N=N2)C3=CC(=C(C=C3)C)Cl)C)OC
InChI=1SC21H23ClN4O3c1529191015(7918(19)284)122321(27)2014(3)26(252420)168613(2)17(22)1116h611H512H214H3(H2327)
MFCD18183531
ZINC000051317857
ZINC51317857
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