Vitas-M small molecule compound
8-[(4-methoxyphenyl)sulfonyl]-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Catalog ID
STK596525
SMILES COc1ccc(cc1)S(=O)(=O)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 C19H21NO5S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO5S/c1-23-16-3-5-17(6-4-16)26(21,22)20-8-7-14-11-18-19(12-15(14)13-20)25-10-2-9-24-18/h3-6,11-12H,2,7-10,13H2,1H3InChIKey
VZITUICVIWZTOR-UHFFFAOYSA-NSynonyms
883960-75-68((4methoxyphenyl)sulfonyl)3478910hexahydro2H(14)dioxepino(23g)isoquinoline
8(4methoxyphenyl)sulfonyl2347910hexahydro(14)dioxepino(23g)isoquinoline
883960756
COC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC4=C(C=C3C2)OCCCO4
InChI=1SC19H21NO5Sc123163517(6416)26(2122)208714111819(1215(14)1320)2510292418h361112H271013H21H3
MFCD06790383
ZINC000005347756
ZINC05347756
ZINC5347756
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