Vitas-M small molecule compound
5-butyl-7-methyl-2-(5-nitrofuran-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Catalog ID
STK782085
SMILES CCCCC12CN3CC(C2=O)(CN(C1)C3c1ccc(o1)[N+](=O)[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 C17H23N3O4 MW 333.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N3O4/c1-3-4-7-17-10-18-8-16(2,15(17)21)9-19(11-17)14(18)12-5-6-13(24-12)20(22)23/h5-6,14H,3-4,7-11H2,1-2H3InChIKey
ZYWXANNVIRPTCP-UHFFFAOYSA-NSynonyms
956042-07-2(1R3S5r7s)5butyl7methyl2(5nitrofuran2yl)13diazaadamantan6one
5butyl7methyl2(5nitrofuran2yl)13diazatricyclo(3311~37~)decan6one
956042072
CCCCC12CN3CC(C1=O)(CN(C2)C3C4=CC=C(O4)(N+)(=O)(O))C
CCCCC12CN3CC(C2=O)(CN(C1)C3c1ccc(o1)(N+)(=O)(O))C
InChI=1SC17H23N3O4c1347171018816(215(17)21)919(1117)14(18)125613(2412)20(22)23h5614H34711H212H3
MFCD04181040
ZINC000019320385
ZINC19320385
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