Vitas-M small molecule compound
1-(morpholin-4-yl)-2-[2-(trifluoromethyl)-7,8-dihydro-1H,6H-[1,4]dioxepino[2,3-f]benzimidazol-1-yl]ethanone
Catalog ID
STL419770
SMILES O=C(N1CCOCC1)Cn1c2cc3OCCCOc3cc2nc1C(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 C17H18F3N3O4 MW 385.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18F3N3O4/c18-17(19,20)16-21-11-8-13-14(27-5-1-4-26-13)9-12(11)23(16)10-15(24)22-2-6-25-7-3-22/h8-9H,1-7,10H2InChIKey
CJWTUAKXMNCWHU-UHFFFAOYSA-NSynonyms
1(morpholin4yl)2(2(trifluoromethyl)78dihydro1H6H(14)dioxepino(23f)benzimidazol1yl)ethanone
1morpholin4yl2(2(trifluoromethyl)78dihydro6H(14)dioxepino(23f)benzimidazol3yl)ethanone
C1COC2=C(C=C3C(=C2)N=C(N3CC(=O)N4CCOCC4)C(F)(F)F)OC1
InChI=1SC17H18F3N3O4c1817(1920)16211181314(275142613)912(11)23(16)1015(24)2226257322h89H1710H2
MFCD30707396
ZINC000101152474
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