Vitas-M small molecule compound

3-azido-2-benzyl-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one

Catalog ID
STK071554
SMILES [N-]=[N+]=NC1N(Cc2ccccc2)C(=O)C2=C1CCCC2

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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 C15H16N4O MW 268.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O/c16-18-17-14-12-8-4-5-9-13(12)15(20)19(14)10-11-6-2-1-3-7-11/h1-3,6-7,14H,4-5,8-10H2
InChIKey
AEKLZTRQKJPRRS-UHFFFAOYSA-N
Synonyms

(N)=(N+)=NC1N(Cc2ccccc2)C(=O)C2=C1CCCC2
3azido2benzyl234567hexahydro1Hisoindol1one
3azido2benzyl4567tetrahydro3Hisoindol1one
C1CCC2=C(C1)C(N(C2=O)CC3=CC=CC=C3)N=(N+)=(N)
InChI=1SC15H16N4Oc1618171412845913(12)15(20)19(14)10116213711h136714H45810H2
MFCD03032440
STK071554
ZINC000020149688
ZINC000020149689

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Available files

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