Vitas-M small molecule compound

N,2-bis[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-6-carboxamide

Catalog ID
STK528644
SMILES COc1ccc(cc1OC)CCNC(=O)c1ccc2c3c1cccc3c(=O)n(c2=O)CCc1ccc(c(c1)OC)OC

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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 C33H32N2O7 MW 568.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32N2O7/c1-39-26-12-8-20(18-28(26)41-3)14-16-34-31(36)23-10-11-25-30-22(23)6-5-7-24(30)32(37)35(33(25)38)17-15-21-9-13-27(40-2)29(19-21)42-4/h5-13,18-19H,14-17H2,1-4H3,(H,34,36)
InChIKey
BAXHRONUISFQEI-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)CCNC(=O)C2=C3C=CC=C4C3=C(C=C2)C(=O)N(C4=O)CCC5=CC(=C(C=C5)OC)OC)OC
InChI=1SC33H32N2O7c1392612820(1828(26)413)14163431(36)231011253022(23)65724(30)32(37)35(33(25)38)17152191327(402)29(1921)424h5131819H1417H214H3(H3436)
MFCD01549407
N2bis(2(34dimethoxyphenyl)ethyl)13dioxo23dihydro1Hbenzo(de)isoquinoline6carboxamide
N2BIS(2(34DIMETHOXYPHENYL)ETHYL)13DIOXOBENZO(DE)ISOQUINOLINE6CARBOXAMIDE
N2bis(34dimethoxyphenethyl)13dioxo23dihydro1Hbenzo(de)isoquinoline6carboxamide
ZINC000102405120
ZINC102405120

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Available files

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