Vitas-M small molecule compound
(9E)-1-methyl-9-[(2E)-(3-nitrobenzylidene)hydrazinylidene]-3,6-diazatricyclo[4.3.1.1~3,8~]undecane
Catalog ID
STK395445
SMILES [O-][N+](=O)c1cccc(c1)/C=N/N=C/1\C2CN3CC1(C)CN(C2)CC3
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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 C17H21N5O2 MW 327.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N5O2/c1-17-11-20-5-6-21(12-17)10-14(9-20)16(17)19-18-8-13-3-2-4-15(7-13)22(23)24/h2-4,7-8,14H,5-6,9-12H2,1H3/b18-8+,19-16+InChIKey
YNQAWFLGWLXYSS-HTPXCUGZSA-NSynonyms
(9E)1methyl9((2E)(3nitrobenzylidene)hydrazinylidene)36diazatricyclo(4311~38~)undecane
(O)(N+)(=O)c1cccc(c1)C=NN=C1C2CN3CC1(C)CN(C2)CC3
(Z)1methyl9((E)(3nitrobenzylidene)hydrazono)36diazatricyclo(4311(38))undecane
CC12CN3CCN(C1)CC(C3)C2=NN=CC4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC17H21N5O2c11711205621(1217)1014(920)16(17)191881332415(713)22(23)24h247814H56912H21H3b188+1916+
MFCD00775777
ZINC000095536758
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