Vitas-M small molecule compound
ethyl 4-[({4-[(3,4-dichlorophenyl)carbamoyl]-5-methyl-1H-1,2,3-triazol-1-yl}acetyl)amino]benzoate
Catalog ID
STL129882
SMILES CCOC(=O)c1ccc(cc1)NC(=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)13-4-6-14(7-5-13)24-18(29)11-28-12(2)19(26-27-28)20(30)25-15-8-9-16(22)17(23)10-15/h4-10H,3,11H2,1-2H3,(H,24,29)(H,25,30)InChIKey
YHUZHIYUMCGZQY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=C(N=N2)C(=O)NC3=CC(=C(C=C3)Cl)Cl)C
ethyl4(((4((34dichlorophenyl)carbamoyl)5methyl1H123triazol1yl)acetyl)amino)benzoate
ethyl4((2(4((34dichlorophenyl)carbamoyl)5methyltriazol1yl)acetyl)amino)benzoate
InChI=1SC21H19Cl2N5O4c133221(31)134614(7513)2418(29)112812(2)19(262728)20(30)25158916(22)17(23)1015h410H311H212H3(H2429)(H2530)
MFCD20748028
ZINC000067323204
ZINC67323204
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