Vitas-M small molecule compound
ethyl 3-[({4-[(2-chlorophenyl)carbamoyl]-5-methyl-1H-1,2,3-triazol-1-yl}acetyl)amino]benzoate
Catalog ID
STL142996
SMILES CCOC(=O)c1cccc(c1)NC(=O)Cn1nnc(c1C)C(=O)Nc1ccccc1Cl
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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 C21H20ClN5O4 MW 441.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN5O4/c1-3-31-21(30)14-7-6-8-15(11-14)23-18(28)12-27-13(2)19(25-26-27)20(29)24-17-10-5-4-9-16(17)22/h4-11H,3,12H2,1-2H3,(H,23,28)(H,24,29)InChIKey
ICQJRVSSHXCRCN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC(=CC=C1)NC(=O)CN2C(=C(N=N2)C(=O)NC3=CC=CC=C3Cl)C
ethyl3(((4((2chlorophenyl)carbamoyl)5methyl1H123triazol1yl)acetyl)amino)benzoate
ethyl3((2(4((2chlorophenyl)carbamoyl)5methyltriazol1yl)acetyl)amino)benzoate
InChI=1SC21H20ClN5O4c133121(30)1476815(1114)2318(28)122713(2)19(252627)20(29)24171054916(17)22h411H312H212H3(H2328)(H2429)
MFCD20747785
ZINC000071327337
ZINC71327337
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