Vitas-M small molecule compound

2-(azepan-1-ylsulfonyl)anthracene-9,10-dione

Catalog ID
STK372059
SMILES O=C1c2cc(ccc2C(=O)c2c1cccc2)S(=O)(=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 C20H19NO4S MW 369.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO4S/c22-19-15-7-3-4-8-16(15)20(23)18-13-14(9-10-17(18)19)26(24,25)21-11-5-1-2-6-12-21/h3-4,7-10,13H,1-2,5-6,11-12H2
InChIKey
VXDURNOBSGHJPY-UHFFFAOYSA-N
Synonyms

2(1AZEPANYLSULFONYL)ANTHRA910QUINONE
2(AZAPERHYDROEPINYLSULFONYL)ANTHRACENE910DIONE
2(azepan1ylsulfonyl)anthracene910dione
2(AZEPANE1SULFONYL)ANTHRAQUINONE
C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O
InChI=1SC20H19NO4Sc221915734816(15)20(23)181314(91017(18)19)26(2425)211151261221h3471013H12561112H2
MFCD00588067
ZINC000004020102
ZINC04020102
ZINC4020102

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Available files

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