Vitas-M small molecule compound
1,1'-{5-[(4-nitrophenyl)carbonyl]-1,3,7-triazabicyclo[3.3.1]nonane-3,7-diyl}diethanone
Catalog ID
STK700460
SMILES CC(=O)N1CN2CN(CC(C1)(C2)C(=O)c1ccc(cc1)[N+](=O)[O-])C(=O)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 C17H20N4O5 MW 360.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O5/c1-12(22)19-8-17(7-18(10-19)11-20(9-17)13(2)23)16(24)14-3-5-15(6-4-14)21(25)26/h3-6H,7-11H2,1-2H3InChIKey
CRNDZTRFRUAGPE-UHFFFAOYSA-NSynonyms
149333-77-71(3ACETYL5(4NITROBENZOYL)137TRIAZABICYCLO(331)NONAN7YL)ETHANONE
1(7ACETYL5(4NITROBENZOYL)137TRIAZABICYCLO(331)NON3YL)ETHANONE
11(5((4NITROPHENYL)CARBONYL)137TRIAZABICYCLO(331)NONANE37DIYL)DIETHANONE
11(5(4nitrobenzoyl)137triazabicyclo(331)nonane37diyl)diethanone
149333777
CC(=O)N1CC2(CN(C1)CN(C2)C(=O)C)C(=O)C3=CC=C(C=C3)(N+)(=O)(O)
CC(=O)N1CN2CN(CC(C1)(C2)C(=O)c1ccc(cc1)(N+)(=O)(O))C(=O)C
InChI=1SC17H20N4O5c112(22)19817(718(1019)1120(917)13(2)23)16(24)143515(6414)21(25)26h36H711H212H3
ZINC000019312970
ZINC19312970
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