Vitas-M small molecule compound

3-(azepan-1-yl)-1-(4-chlorophenyl)-1H-pyrrole-2,5-dione

Catalog ID
STK233769
SMILES Clc1ccc(cc1)N1C(=O)C=C(C1=O)N1CCCCCC1

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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 C16H17ClN2O2 MW 304.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN2O2/c17-12-5-7-13(8-6-12)19-15(20)11-14(16(19)21)18-9-3-1-2-4-10-18/h5-8,11H,1-4,9-10H2
InChIKey
BBWQGICAEUNMPA-UHFFFAOYSA-N
Synonyms
879617-88-6
3(azepan1yl)1(4chlorophenyl)1Hpyrrole25dione
3(AZEPAN1YL)1(4CHLOROPHENYL)PYRROLE25DIONE
3AZAPERHYDROEPINYL1(4CHLOROPHENYL)AZOLINE25DIONE
879617886
C1CCCN(CC1)C2=CC(=O)N(C2=O)C3=CC=C(C=C3)Cl
InChI=1SC16H17ClN2O2c17125713(8612)1915(20)1114(16(19)21)18931241018h5811H14910H2
MFCD07181325
ZINC000005425999
ZINC05425999
ZINC5425999

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Available files

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