Vitas-M small molecule compound
8-methyl-N-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Catalog ID
STL504885
SMILES O=C(c1cc2OCCCOc2cc1C)Nc1cccc(c1)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 C18H16F3NO3 MW 351.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16F3NO3/c1-11-8-15-16(25-7-3-6-24-15)10-14(11)17(23)22-13-5-2-4-12(9-13)18(19,20)21/h2,4-5,8-10H,3,6-7H2,1H3,(H,22,23)InChIKey
NDQONEKZVFZVBV-UHFFFAOYSA-NSynonyms
45922802
8methyl~(N)(3(trifluoromethyl)phenyl)34dihydro2~(H)15benzodioxepine7carboxamide
8methylN(3(trifluoromethyl)phenyl)34dihydro2H15benzodioxepine7carboxamide
InChI=1SC18H16F3NO3c11181516(257362415)1014(11)17(23)221352412(913)18(1920)21h245810H367H21H3(H2223)
MFCD27220796
ZINC000046077768
ZINC46077768
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