Vitas-M small molecule compound

6-(azepan-1-ylsulfonyl)-3-[2-(morpholin-4-yl)-2-oxoethyl]-1,3-benzoxazol-2(3H)-one

Catalog ID
STK983588
SMILES O=C(N1CCOCC1)Cn1c(=O)oc2c1ccc(c2)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 C19H25N3O6S MW 423.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N3O6S/c23-18(20-9-11-27-12-10-20)14-22-16-6-5-15(13-17(16)28-19(22)24)29(25,26)21-7-3-1-2-4-8-21/h5-6,13H,1-4,7-12,14H2
InChIKey
SPWAQODCQDFAPK-UHFFFAOYSA-N
Synonyms

6(azepan1ylsulfonyl)3(2(morpholin4yl)2oxoethyl)13benzoxazol2(3H)one
6(azepan1ylsulfonyl)3(2morpholin4yl2oxoethyl)13benzoxazol2one
C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CC(=O)N4CCOCC4
InChI=1SC19H25N3O6Sc2318(2091127121020)1422166515(1317(16)2819(22)24)29(2526)2173124821h5613H1471214H2
MFCD08847798
ZINC000006808816
ZINC06808816
ZINC6808816

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Available files

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