Vitas-M small molecule compound

6-bromo-2-(1,3,5-trimethyl-1H-pyrazol-4-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione

Catalog ID
STK762230
SMILES Brc1ccc2c3c1cccc3c(=O)n(c2=O)c1c(C)nn(c1C)C

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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 C18H14BrN3O2 MW 384.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14BrN3O2/c1-9-16(10(2)21(3)20-9)22-17(23)12-6-4-5-11-14(19)8-7-13(15(11)12)18(22)24/h4-8H,1-3H3
InChIKey
JMLNXNGLKMEXFL-UHFFFAOYSA-N
Synonyms
309738-44-1
309738441
6BROMANYL2(135TRIMETHYLPYRAZOL4YL)BENZO(DE)ISOQUINOLINE13DIONE
6bromo2(135trimethyl1Hpyrazol4yl)1Hbenzo(de)isoquinoline13(2H)dione
6BROMO2(135TRIMETHYL1HPYRAZOL4YL)BENZO(DE)ISOQUINOLINE13DIONE
6BROMO2(135TRIMETHYL4PYRAZOLYL)BENZO(DE)ISOQUINOLINE13DIONE
6BROMO2(135TRIMETHYLPYRAZOL4YL)BENZO(DE)ISOQUINOLINE13DIONE
6BROMO2(135TRIMETHYLPYRAZOL4YL)BENZO(DE)ISOQUINOLINE13QUINONE
CC1=C(C(=NN1C)C)N2C(=O)C3=C4C(=C(C=C3)Br)C=CC=C4C2=O
InChI=1SC18H14BrN3O2c1916(10(2)21(3)209)2217(23)126451114(19)8713(15(11)12)18(22)24h48H13H3
MFCD01191000
ZINC000000840951
ZINC00840951
ZINC840951

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Available files

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