Vitas-M small molecule compound

5-[3-(4-methoxyphenoxy)propyl]-3-methyl-4-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-1-carbaldehyde

Catalog ID
STL560765
SMILES O=CN1CC(C)C(=O)N(c2c1cccc2)CCCOc1ccc(cc1)OC

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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 C21H24N2O4 MW 368.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4/c1-16-14-22(15-24)19-6-3-4-7-20(19)23(21(16)25)12-5-13-27-18-10-8-17(26-2)9-11-18/h3-4,6-11,15-16H,5,12-14H2,1-2H3
InChIKey
RXGKKCBMEOXWAF-UHFFFAOYSA-N
Synonyms
941514-70-1
17601659
5(3(4methoxyphenoxy)propyl)3methyl4oxo2345tetrahydro1H15benzodiazepine1carbaldehyde
5(3(4methoxyphenoxy)propyl)3methyl4oxo2345tetrahydro1Hbenzo(b)(14)diazepine1carbaldehyde
5(3(4methoxyphenoxy)propyl)3methyl4oxo23dihydro15benzodiazepine1carbaldehyde
941514701
InChI=1SC21H24N2O4c1161422(1524)19634720(19)23(21(16)25)12513271810817(262)91118h346111516H51214H212H3
MFCD08834579
ZINC000009073263
ZINC000009073264

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Available files

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