Vitas-M small molecule compound
(4-butylphenyl)(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)methanone
Catalog ID
STK603567
SMILES CCCCc1ccc(cc1)C(=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 C24H29NO3 MW 379.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29NO3/c1-3-4-6-18-7-9-19(10-8-18)24(26)25-12-11-20-15-22-23(16-21(20)17(25)2)28-14-5-13-27-22/h7-10,15-17H,3-6,11-14H2,1-2H3InChIKey
XHMMFFVIWUJGTG-UHFFFAOYSA-NSynonyms
(4butylphenyl)(7methyl2347910hexahydro(14)dioxepino(23g)isoquinolin8yl)methanone
(4butylphenyl)(7methyl34910tetrahydro2H(14)dioxepino(23g)isoquinolin8(7H)yl)methanone
CCCCC1=CC=C(C=C1)C(=O)N2CCC3=CC4=C(C=C3C2C)OCCCO4
InChI=1SC24H29NO3c1346187919(10818)24(26)25121120152223(1621(20)17(25)2)28145132722h7101517H361114H212H3
MFCD08287860
ZINC000006719870
ZINC000006719871
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