Vitas-M small molecule compound
2-[4-(2-benzyl-1,1-dioxido-3,4-dihydro-2H-1,2,4-benzothiadiazin-3-yl)phenoxy]-1-(piperidin-1-yl)ethanone
Catalog ID
STL061563
SMILES O=C(N1CCCCC1)COc1ccc(cc1)C1Nc2ccccc2S(=O)(=O)N1Cc1ccccc1
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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 C27H29N3O4S MW 491.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O4S/c31-26(29-17-7-2-8-18-29)20-34-23-15-13-22(14-16-23)27-28-24-11-5-6-12-25(24)35(32,33)30(27)19-21-9-3-1-4-10-21/h1,3-6,9-16,27-28H,2,7-8,17-20H2InChIKey
HEYGNGPYMGBJMJ-UHFFFAOYSA-NSynonyms
2(4(2benzyl11dioxido34dihydro2H124benzothiadiazin3yl)phenoxy)1(piperidin1yl)ethanone
2(4(2benzyl11dioxo34dihydro1$l^(6)24benzothiadiazin3yl)phenoxy)1piperidin1ylethanone
C1CCN(CC1)C(=O)COC2=CC=C(C=C2)C3NC4=CC=CC=C4S(=O)(=O)N3CC5=CC=CC=C5
InChI=1SC27H29N3O4Sc3126(29177281829)203423151322(141623)27282411561225(24)35(3233)30(27)192193141021h1369162728H2781720H2
MFCD03828380
ZINC000001462403
ZINC000001462405
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