Vitas-M small molecule compound

2-(5-nitrofuran-2-yl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one

Catalog ID
STK381353
SMILES CCCC12CN3CC(C2=O)(CN(C1)C3c1ccc(o1)[N+](=O)[O-])CCC

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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 C18H25N3O4 MW 347.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N3O4/c1-3-7-17-9-19-11-18(8-4-2,16(17)22)12-20(10-17)15(19)13-5-6-14(25-13)21(23)24/h5-6,15H,3-4,7-12H2,1-2H3
InChIKey
NASKTTUPRXSSRC-UHFFFAOYSA-N
Synonyms
429651-32-1
(1r5R7S)2(5nitrofuran2yl)57dipropyl13diazaadamantan6one
2(5nitrofuran2yl)57dipropyl13diazatricyclo(3311~37~)decan6one
429651321
CCC(C@)12CN3C(C@@)(C2=O)(CN(C1)C3c1ccc(o1)(N+)(=O)(O))CCC
CCCC12CN3CC(C1=O)(CN(C2)C3C4=CC=C(O4)(N+)(=O)(O))CCC
CCCC12CN3CC(C2=O)(CN(C1)C3c1ccc(o1)(N+)(=O)(O))CCC
InChI=1SC18H25N3O4c137179191118(84216(17)22)1220(1017)15(19)135614(2513)21(23)24h5615H34712H212H3
MFCD03016306
ZINC000019323193
ZINC19323193

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Available files

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