Vitas-M small molecule compound

N-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)-N'-(3,4-dihydro-1H-isochromen-1-ylmethyl)ethanediamide

Catalog ID
STK857381
SMILES O=C(C(=O)NCC1COc2c(O1)cccc2)NCC1OCCc2c1cccc2

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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 C21H22N2O5 MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O5/c24-20(22-11-15-13-27-17-7-3-4-8-18(17)28-15)21(25)23-12-19-16-6-2-1-5-14(16)9-10-26-19/h1-8,15,19H,9-13H2,(H,22,24)(H,23,25)
InChIKey
RXDNCRKKOSRSEY-UHFFFAOYSA-N
Synonyms
445264-68-6
445264686
C1COC(C2=CC=CC=C21)CNC(=O)C(=O)NCC3COC4=CC=CC=C4O3
InChI=1SC21H22N2O5c2420(221115132717734818(17)2815)21(25)23121916621514(16)9102619h181519H913H2(H2224)(H2325)
MFCD03270428
N((2R)23DIHYDRO14BENZODIOXIN2YLMETHYL)N((1S)34DIHYDRO1HISOCHROMEN1YLMETHYL)ETHANEDIAMIDE
N((2S)23DIHYDRO14BENZODIOXIN2YLMETHYL)N((1R)34DIHYDRO1HISOCHROMEN1YLMETHYL)ETHANEDIAMIDE
N(23dihydro14benzodioxin2ylmethyl)N(34dihydro1Hisochromen1ylmethyl)ethanediamide
N(23DIHYDRO14BENZODIOXIN3YLMETHYL)N(34DIHYDRO1HISOCHROMEN1YLMETHYL)OXAMIDE
N(23DIHYDROBENZO(14)DIOXIN2YLMETHYL)NISOCHROMAN1YLMETHYLOXALAMIDE
N1((23dihydrobenzo(b)(14)dioxin2yl)methyl)N2(isochroman1ylmethyl)oxalamide
ZINC000002846048
ZINC000002846051

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.