Vitas-M small molecule compound
8-[(4-ethoxyphenyl)sulfonyl]-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Catalog ID
STK578933
SMILES CCOc1ccc(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 C20H23NO5S MW 389.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO5S/c1-2-24-17-4-6-18(7-5-17)27(22,23)21-9-8-15-12-19-20(13-16(15)14-21)26-11-3-10-25-19/h4-7,12-13H,2-3,8-11,14H2,1H3InChIKey
HCKYQSMSEANPJV-UHFFFAOYSA-NSynonyms
883960-71-28((4ethoxyphenyl)sulfonyl)3478910hexahydro2H(14)dioxepino(23g)isoquinoline
8(4ethoxyphenyl)sulfonyl2347910hexahydro(14)dioxepino(23g)isoquinoline
883960712
CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC4=C(C=C3C2)OCCCO4
InChI=1SC20H23NO5Sc1224174618(7517)27(2223)219815121920(1316(15)1421)26113102519h471213H2381114H21H3
MFCD06784648
ZINC000005345391
ZINC05345391
ZINC5345391
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