Vitas-M small molecule compound

N-[1-(azepan-1-yl)-1-oxopropan-2-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)methanesulfonamide

Catalog ID
STL259641
SMILES O=C(C(N(S(=O)(=O)C)c1ccc2c(c1)OCCO2)C)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 C18H26N2O5S MW 382.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26N2O5S/c1-14(18(21)19-9-5-3-4-6-10-19)20(26(2,22)23)15-7-8-16-17(13-15)25-12-11-24-16/h7-8,13-14H,3-6,9-12H2,1-2H3
InChIKey
SIEYMASJADZCES-UHFFFAOYSA-N
Synonyms

CC(C(=O)N1CCCCCC1)N(C2=CC3=C(C=C2)OCCO3)S(=O)(=O)C
InChI=1SC18H26N2O5Sc114(18(21)19953461019)20(26(222)23)15781617(1315)2512112416h781314H36912H212H3
MFCD09872433
N(1(azepan1yl)1oxopropan2yl)N(23dihydro14benzodioxin6yl)methanesulfonamide
ZINC000012380379
ZINC000012380380

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Available files

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