Vitas-M small molecule compound

N-(4-bromo-2-ethylphenyl)-3-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)propanamide

Catalog ID
STK275086
SMILES CCc1cc(Br)ccc1NC(=O)CCN1C(=O)C2C(C1=O)C1CC2CC1

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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 C20H23BrN2O3 MW 419.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23BrN2O3/c1-2-11-10-14(21)5-6-15(11)22-16(24)7-8-23-19(25)17-12-3-4-13(9-12)18(17)20(23)26/h5-6,10,12-13,17-18H,2-4,7-9H2,1H3,(H,22,24)
InChIKey
SRQJTAFSHJLSGN-UHFFFAOYSA-N
Synonyms

CCC1=C(C=CC(=C1)Br)NC(=O)CCN2C(=O)C3C4CCC(C4)C3C2=O
InChI=1SC20H23BrN2O3c12111014(21)5615(11)2216(24)782319(25)17123413(912)18(17)20(23)26h561012131718H2479H21H3(H2224)
MFCD03185276
N(4bromo2ethylphenyl)3(13dioxooctahydro2H47methanoisoindol2yl)propanamide
ZINC000101328968
ZINC000101697279

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Available files

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