Vitas-M small molecule compound

methyl 7-(3-bromophenyl)-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate

Catalog ID
STK542887
SMILES COC(=O)C1=NNC2(C1)CC(=O)N(C2=O)c1cccc(c1)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 C14H12BrN3O4 MW 366.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12BrN3O4/c1-22-12(20)10-6-14(17-16-10)7-11(19)18(13(14)21)9-4-2-3-8(15)5-9/h2-5,17H,6-7H2,1H3
InChIKey
GOJDVMLCZZEQGL-UHFFFAOYSA-N
Synonyms
371218-21-2
371218212
COC(=O)C1=NNC2(C1)CC(=O)N(C2=O)C3=CC(=CC=C3)Br
InChI=1SC14H12BrN3O4c12212(20)10614(171610)711(19)18(13(14)21)94238(15)59h2517H67H21H3
methyl7(3bromophenyl)68dioxo127triazaspiro(44)non2ene3carboxylate
METHYL8(3BROMOPHENYL)79DIOXO348TRIAZASPIRO(44)NON2ENE2CARBOXYLATE
MFCD03010199
ZINC000004844496
ZINC000004844497

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Available files

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