Vitas-M small molecule compound
2-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(piperidin-1-yl)-5-(trifluoromethyl)phenyl]acetamide
Catalog ID
STL381733
SMILES O=C(CN1C(=O)c2c(S1(=O)=O)cccc2)Nc1cc(ccc1N1CCCCC1)C(F)(F)F
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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 C21H20F3N3O4S MW 467.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F3N3O4S/c22-21(23,24)14-8-9-17(26-10-4-1-5-11-26)16(12-14)25-19(28)13-27-20(29)15-6-2-3-7-18(15)32(27,30)31/h2-3,6-9,12H,1,4-5,10-11,13H2,(H,25,28)InChIKey
VLLDXQYFWVIJIH-UHFFFAOYSA-NSynonyms
2(11dioxido3oxo12benzothiazol2(3H)yl)N(2(piperidin1yl)5(trifluoromethyl)phenyl)acetamide
C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CN3C(=O)C4=CC=CC=C4S3(=O)=O
InChI=1SC21H20F3N3O4Sc2221(2324)148917(26104151126)16(1214)2519(28)132720(29)15623718(15)32(2730)31h236912H145101113H2(H2528)
MFCD08087806
N(2piperidin1yl5(trifluoromethyl)phenyl)2(113trioxo12benzothiazol2yl)acetamide
ZINC000009236634
ZINC09236634
ZINC9236634
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