Vitas-M small molecule compound

N-[2-methyl-3-(1H-pyrrol-1-yl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Catalog ID
STL504890
SMILES O=C(c1ccc2c(c1)OCCCO2)Nc1cccc(c1C)n1cccc1

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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 C21H20N2O3 MW 348.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O3/c1-15-17(6-4-7-18(15)23-10-2-3-11-23)22-21(24)16-8-9-19-20(14-16)26-13-5-12-25-19/h2-4,6-11,14H,5,12-13H2,1H3,(H,22,24)
InChIKey
UCKQBAZDYQQPHS-UHFFFAOYSA-N
Synonyms

~(N)(2methyl3pyrrol1ylphenyl)34dihydro2~(H)15benzodioxepine7carboxamide
45921504
InChI=1SC21H20N2O3c11517(64718(15)2310231123)2221(24)16891920(1416)26135122519h2461114H51213H21H3(H2224)
MFCD27221100
N(2methyl3(1Hpyrrol1yl)phenyl)34dihydro2H15benzodioxepine7carboxamide
ZINC000046077854
ZINC46077854

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Available files

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