Vitas-M small molecule compound
(2E)-1-(5-bromofuran-2-yl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanone
Catalog ID
STK571226
SMILES Brc1ccc(o1)C(=O)/C=C\1/NCCc2c1cc1OCCCOc1c2
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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 C18H16BrNO4 MW 390.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrNO4/c19-18-3-2-15(24-18)14(21)10-13-12-9-17-16(22-6-1-7-23-17)8-11(12)4-5-20-13/h2-3,8-10,20H,1,4-7H2/b13-10+InChIKey
RKMJRJKKFNFFEK-JLHYYAGUSA-NSynonyms
892628-10-3(2E)1(5bromofuran2yl)2(2348910hexahydro(14)dioxepino(23g)isoquinolin7ylidene)ethanone
(2E)1(5bromofuran2yl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)ethanone
(E)1(5bromofuran2yl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)ethanone
892628103
Brc1ccc(o1)C(=O)C=C1NCCc2c1cc1OCCCOc1c2
C1COC2=C(C=C3C(=C2)CCNC3=CC(=O)C4=CC=C(O4)Br)OC1
InChI=1SC18H16BrNO4c19183215(2418)14(21)10131291716(226172317)811(12)452013h2381020H147H2b1310+
MFCD07640212
ZINC000101087715
ZINC101087715
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