Vitas-M small molecule compound
ethyl 4-[({4-[(2-fluorophenyl)carbamoyl]-5-methyl-1H-1,2,3-triazol-1-yl}acetyl)amino]benzoate
Catalog ID
STL129891
SMILES CCOC(=O)c1ccc(cc1)NC(=O)Cn1nnc(c1C)C(=O)Nc1ccccc1F
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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 C21H20FN5O4 MW 425.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FN5O4/c1-3-31-21(30)14-8-10-15(11-9-14)23-18(28)12-27-13(2)19(25-26-27)20(29)24-17-7-5-4-6-16(17)22/h4-11H,3,12H2,1-2H3,(H,23,28)(H,24,29)InChIKey
CPEPIBHKNSWYDF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=C(N=N2)C(=O)NC3=CC=CC=C3F)C
ethyl4(((4((2fluorophenyl)carbamoyl)5methyl1H123triazol1yl)acetyl)amino)benzoate
ethyl4((2(4((2fluorophenyl)carbamoyl)5methyltriazol1yl)acetyl)amino)benzoate
InChI=1SC21H20FN5O4c133121(30)1481015(11914)2318(28)122713(2)19(252627)20(29)2417754616(17)22h411H312H212H3(H2328)(H2429)
MFCD20748037
ZINC000067323224
ZINC67323224
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