Vitas-M small molecule compound

2-(4-amino-3-bromo-5-chlorophenyl)-4-nitro-1H-isoindole-1,3(2H)-dione

Catalog ID
STK247622
SMILES O=C1c2cccc(c2C(=O)N1c1cc(Cl)c(c(c1)Br)N)[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 C14H7BrClN3O4 MW 396.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H7BrClN3O4/c15-8-4-6(5-9(16)12(8)17)18-13(20)7-2-1-3-10(19(22)23)11(7)14(18)21/h1-5H,17H2
InChIKey
OSXUPHSAHJXIRH-UHFFFAOYSA-N
Synonyms

2(4amino3bromo5chlorophenyl)4nitro1Hisoindole13(2H)dione
2(4AMINO3BROMO5CHLOROPHENYL)4NITROBENZO(C)AZOLINE13DIONE
2(4AMINO3BROMO5CHLOROPHENYL)4NITROISOINDOLE13DIONE
C1=CC2=C(C(=C1)(N+)(=O)(O))C(=O)N(C2=O)C3=CC(=C(C(=C3)Br)N)Cl
InChI=1SC14H7BrClN3O4c15846(59(16)12(8)17)1813(20)721310(19(22)23)11(7)14(18)21h15H17H2
MFCD00396478
O=C1c2cccc(c2C(=O)N1c1cc(Cl)c(c(c1)Br)N)(N+)(=O)(O)
ZINC000001084788
ZINC01084788
ZINC1084788

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Available files

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