Vitas-M small molecule compound
8-{[2-(trifluoromethyl)phenyl]sulfonyl}-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Catalog ID
STK590141
SMILES O=S(=O)(c1ccccc1C(F)(F)F)N1CCc2c(C1)cc1c(c2)OCCCO1
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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 C19H18F3NO4S MW 413.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18F3NO4S/c20-19(21,22)15-4-1-2-5-18(15)28(24,25)23-7-6-13-10-16-17(11-14(13)12-23)27-9-3-8-26-16/h1-2,4-5,10-11H,3,6-9,12H2InChIKey
UITPUKXQWKGNPZ-UHFFFAOYSA-NSynonyms
883960-09-68((2(trifluoromethyl)phenyl)sulfonyl)3478910hexahydro2H(14)dioxepino(23g)isoquinoline
8(2(trifluoromethyl)phenyl)sulfonyl2347910hexahydro(14)dioxepino(23g)isoquinoline
883960096
C1COC2=C(C=C3CN(CCC3=C2)S(=O)(=O)C4=CC=CC=C4C(F)(F)F)OC1
InChI=1SC19H18F3NO4Sc2019(2122)15412518(15)28(2425)237613101617(1114(13)1223)279382616h12451011H36912H2
MFCD06791426
ZINC000005348345
ZINC05348345
ZINC5348345
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