Vitas-M small molecule compound

5-(6-bromo-4-oxo-4H-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)-1H-isoindole-1,3(2H)-dione

Catalog ID
STK223190
SMILES CC(CCN1C(=O)c2c(C1=O)cc(cc2)c1nc2ccc(cc2c(=O)o1)Br)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 C21H17BrN2O4 MW 441.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrN2O4/c1-11(2)7-8-24-19(25)14-5-3-12(9-15(14)20(24)26)18-23-17-6-4-13(22)10-16(17)21(27)28-18/h3-6,9-11H,7-8H2,1-2H3
InChIKey
UFNPXDAHUFVUKK-UHFFFAOYSA-N
Synonyms

5(6BROMO4OXO31BENZOXAZIN2YL)2(3METHYLBUTYL)ISOINDOLE13DIONE
5(6bromo4oxo4H31benzoxazin2yl)2(3methylbutyl)1Hisoindole13(2H)dione
5(6BROMO4OXO4H31BENZOXAZIN2YL)2ISOPENTYL1HISOINDOLE13(2H)DIONE
5(6bromo4oxo4Hbenzo(d)(13)oxazin2yl)2isopentylisoindoline13dione
CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C3=NC4=C(C=C(C=C4)Br)C(=O)O3
InChI=1SC21H17BrN2O4c111(2)782419(25)145312(915(14)20(24)26)1823176413(22)1016(17)21(27)2818h36911H78H212H3
MFCD01974141
ZINC000000692327
ZINC00692327
ZINC692327

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Available files

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