Vitas-M small molecule compound
5-methyl-N-(3-oxo-1,3-dihydro-2-benzofuran-5-yl)-1-(4-propoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL017836
SMILES CCCOc1ccc(cc1)n1nnc(c1C)C(=O)Nc1ccc2c(c1)C(=O)OC2
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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 C21H20N4O4 MW 392.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4/c1-3-10-28-17-8-6-16(7-9-17)25-13(2)19(23-24-25)20(26)22-15-5-4-14-12-29-21(27)18(14)11-15/h4-9,11H,3,10,12H2,1-2H3,(H,22,26)InChIKey
WIORWTBJFIMZQD-UHFFFAOYSA-NSynonyms
(5METHYL1(4PROPOXYPHENYL)(123TRIAZOL4YL))N(3OXOHYDROISOBENZOFURAN5YL)CARBOXAMIDE
5methylN(3oxo13dihydro2benzofuran5yl)1(4propoxyphenyl)1H123triazole4carboxamide
5methylN(3oxo1H2benzofuran5yl)1(4propoxyphenyl)triazole4carboxamide
CCCOC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)NC3=CC4=C(COC4=O)C=C3)C
InChI=1SC21H20N4O4c131028178616(7917)2513(2)19(232425)20(26)22155414122921(27)18(14)1115h4911H31012H212H3(H2226)
MFCD09874976
ZINC000012274035
ZINC12274035
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