Vitas-M small molecule compound

ethyl 1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxylate

Catalog ID
STL133813
SMILES CCOC(=O)c1nnn(c1)CC(=O)Nc1ccc2c(c1)OCCO2

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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 C15H16N4O5 MW 332.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O5/c1-2-22-15(21)11-8-19(18-17-11)9-14(20)16-10-3-4-12-13(7-10)24-6-5-23-12/h3-4,7-8H,2,5-6,9H2,1H3,(H,16,20)
InChIKey
CXQVCUBHLQJWOT-UHFFFAOYSA-N
Synonyms
892293-59-3
892293593
CCOC(=O)C1=CN(N=N1)CC(=O)NC2=CC3=C(C=C2)OCCO3
ethyl1(2(23dihydro14benzodioxin6ylamino)2oxoethyl)1H123triazole4carboxylate
ETHYL1(2(23DIHYDRO14BENZODIOXIN6YLAMINO)2OXOETHYL)TRIAZOLE4CARBOXYLATE
InChI=1SC15H16N4O5c122215(21)11819(181711)914(20)1610341213(710)24652312h3478H2569H21H3(H1620)
MFCD14726150
ZINC000003906914
ZINC3906914

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Available files

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