Vitas-M small molecule compound

diethyl 1-{2-[(2-carbamoylphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate

Catalog ID
STL081301
SMILES CCOC(=O)c1n(nnc1C(=O)OCC)CC(=O)Nc1ccccc1C(=O)N

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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 C17H19N5O6 MW 389.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N5O6/c1-3-27-16(25)13-14(17(26)28-4-2)22(21-20-13)9-12(23)19-11-8-6-5-7-10(11)15(18)24/h5-8H,3-4,9H2,1-2H3,(H2,18,24)(H,19,23)
InChIKey
QUIRWWUXSGTRHL-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(N=N1)CC(=O)NC2=CC=CC=C2C(=O)N)C(=O)OCC
diethyl1(2((2carbamoylphenyl)amino)2oxoethyl)1H123triazole45dicarboxylate
diethyl1(2(2carbamoylanilino)2oxoethyl)triazole45dicarboxylate
InChI=1SC17H19N5O6c132716(25)1314(17(26)2842)22(212013)912(23)1911865710(11)15(18)24h58H349H212H3(H21824)(H1923)
MFCD14749662
ZINC000004176338
ZINC04176338
ZINC4176338

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.