Vitas-M small molecule compound

N-(4-bromo-2-methylphenyl)-2-(3-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide

Catalog ID
STK073359
SMILES Brc1ccc(c(c1)C)NC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-]

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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 C22H14BrN3O5 MW 480.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14BrN3O5/c1-12-9-14(23)6-8-19(12)24-20(27)13-5-7-17-18(10-13)22(29)25(21(17)28)15-3-2-4-16(11-15)26(30)31/h2-11H,1H3,(H,24,27)
InChIKey
BVLHPYVDZGXOQK-UHFFFAOYSA-N
Synonyms

Brc1ccc(c(c1)C)NC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)(N+)(=O)(O)
CC1=C(C=CC(=C1)Br)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC22H14BrN3O5c112914(23)6819(12)2420(27)13571718(1013)22(29)25(21(17)28)1532416(1115)26(30)31h211H1H3(H2427)
MFCD01158990
N(4BROMO2METHYLPHENYL)2(3NITROPHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXAMIDE
N(4BROMO2METHYLPHENYL)2(3NITROPHENYL)13DIOXOISOINDOLE5CARBOXAMIDE
STK073359
ZINC000001208964
ZINC01208964
ZINC1208964

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Available files

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