Vitas-M small molecule compound

ethyl (3-methyl-4-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)(oxo)acetate

Catalog ID
STL232373
SMILES CCOC(=O)C(=O)N1CC(C)C(=O)Nc2c1cccc2

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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 C14H16N2O4 MW 276.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2O4/c1-3-20-14(19)13(18)16-8-9(2)12(17)15-10-6-4-5-7-11(10)16/h4-7,9H,3,8H2,1-2H3,(H,15,17)
InChIKey
PWCDKGOFXZOYHA-UHFFFAOYSA-N
Synonyms
874794-80-6
874794806
CCOC(=O)C(=O)N1CC(C(=O)NC2=CC=CC=C21)C
ethyl(3methyl4oxo2345tetrahydro1H15benzodiazepin1yl)(oxo)acetate
ethyl2(3methyl2oxo34dihydro1H15benzodiazepin5yl)2oxoacetate
ethyl2(3methyl4oxo2345tetrahydro1Hbenzo(b)(14)diazepin1yl)2oxoacetate
InChI=1SC14H16N2O4c132014(19)13(18)1689(2)12(17)1510645711(10)16h479H38H212H3(H1517)
MFCD00269128
ZINC000009183711
ZINC000009183712

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Available files

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