Vitas-M small molecule compound
[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)piperazin-1-yl](3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanone
Catalog ID
STK658102
SMILES O=C(c1ccc2c(c1)OCCCO2)N1CCN(CC1)S(=O)(=O)c1cccc2c1non2
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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 C20H20N4O6S MW 444.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O6S/c25-20(14-5-6-16-17(13-14)29-12-2-11-28-16)23-7-9-24(10-8-23)31(26,27)18-4-1-3-15-19(18)22-30-21-15/h1,3-6,13H,2,7-12H2InChIKey
ZBCZQMUWTHECBA-UHFFFAOYSA-NSynonyms
1190254-33-1(4(213benzoxadiazol4ylsulfonyl)piperazin1yl)(34dihydro2H15benzodioxepin7yl)methanone
(4(benzo(c)(125)oxadiazol4ylsulfonyl)piperazin1yl)(34dihydro2Hbenzo(b)(14)dioxepin7yl)methanone
1190254331
C1COC2=C(C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC5=NON=C54)OC1
InChI=1SC20H20N4O6Sc2520(14561617(1314)29122112816)237924(10823)31(2627)184131519(18)22302115h13613H2712H2
MFCD13760772
ZINC000036366263
ZINC36366263
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