Vitas-M small molecule compound

8-[(4-fluorophenyl)sulfonyl]-7-methyl-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline

Catalog ID
STK593039
SMILES Fc1ccc(cc1)S(=O)(=O)N1CCc2c(C1C)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 C19H20FNO4S MW 377.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20FNO4S/c1-13-17-12-19-18(24-9-2-10-25-19)11-14(17)7-8-21(13)26(22,23)16-5-3-15(20)4-6-16/h3-6,11-13H,2,7-10H2,1H3
InChIKey
WFZZRUMCUOZPHP-UHFFFAOYSA-N
Synonyms
883950-60-5
8((4fluorophenyl)sulfonyl)7methyl3478910hexahydro2H(14)dioxepino(23g)isoquinoline
8(4fluorophenyl)sulfonyl7methyl2347910hexahydro(14)dioxepino(23g)isoquinoline
883950605
CC1C2=CC3=C(C=C2CCN1S(=O)(=O)C4=CC=C(C=C4)F)OCCCO3
InChI=1SC19H20FNO4Sc11317121918(2492102519)1114(17)7821(13)26(2223)165315(20)4616h361113H2710H21H3
MFCD07638755
ZINC000005422163
ZINC000005422175

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.