Vitas-M small molecule compound
ethyl 2-[({4-[(3,4-dichlorophenyl)carbamoyl]-5-methyl-1H-1,2,3-triazol-1-yl}acetyl)amino]benzoate
Catalog ID
STL142718
SMILES CCOC(=O)c1ccccc1NC(=O)Cn1nnc(c1C)C(=O)Nc1ccc(c(c1)Cl)Cl
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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 C21H19Cl2N5O4 MW 476.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Cl2N5O4/c1-3-32-21(31)14-6-4-5-7-17(14)25-18(29)11-28-12(2)19(26-27-28)20(30)24-13-8-9-15(22)16(23)10-13/h4-10H,3,11H2,1-2H3,(H,24,30)(H,25,29)InChIKey
BFBCKYHICIFRLA-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=CC=C1NC(=O)CN2C(=C(N=N2)C(=O)NC3=CC(=C(C=C3)Cl)Cl)C
ethyl2(((4((34dichlorophenyl)carbamoyl)5methyl1H123triazol1yl)acetyl)amino)benzoate
ethyl2((2(4((34dichlorophenyl)carbamoyl)5methyltriazol1yl)acetyl)amino)benzoate
InChI=1SC21H19Cl2N5O4c133221(31)14645717(14)2518(29)112812(2)19(262728)20(30)24138915(22)16(23)1013h410H311H212H3(H2430)(H2529)
MFCD20747330
ZINC000071327059
ZINC71327059
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