Vitas-M small molecule compound

N-(4-bromo-5-chloro-2-methylphenyl)-2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-3-phenylpropanamide

Catalog ID
STK257909
SMILES O=C(C(N1C(=O)C2C(C1=O)C1CC2C=C1)Cc1ccccc1)Nc1cc(Cl)c(cc1C)Br

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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 C25H22BrClN2O3 MW 513.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrClN2O3/c1-13-9-17(26)18(27)12-19(13)28-23(30)20(10-14-5-3-2-4-6-14)29-24(31)21-15-7-8-16(11-15)22(21)25(29)32/h2-9,12,15-16,20-22H,10-11H2,1H3,(H,28,30)
InChIKey
KZNZKOFUVOPGET-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C=C1NC(=O)C(CC2=CC=CC=C2)N3C(=O)C4C5CC(C4C3=O)C=C5)Cl)Br
InChI=1SC25H22BrClN2O3c113917(26)18(27)1219(13)2823(30)20(10145324614)2924(31)21157816(1115)22(21)25(29)32h291215162022H1011H21H3(H2830)
MFCD03104023
N(4BROMO5CHLORO2METHYLPHENYL)2(13DIOXO133A477AHEXAHYDRO2H47METHANOISOINDOL2YL)3PHENYLPROPANAMIDE
ZINC000102087410
ZINC000239135288

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Available files

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