Vitas-M small molecule compound

N~6~-benzyl-N~4~,N~4~-diethyl-7-nitro-2,1,3-benzoxadiazole-4,6-diamine

Catalog ID
STK541612
SMILES CCN(c1cc(NCc2ccccc2)c(c2c1non2)[N+](=O)[O-])CC

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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 C17H19N5O3 MW 341.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N5O3/c1-3-21(4-2)14-10-13(18-11-12-8-6-5-7-9-12)17(22(23)24)16-15(14)19-25-20-16/h5-10,18H,3-4,11H2,1-2H3
InChIKey
HPEXMMBDZONIDM-UHFFFAOYSA-N
Synonyms
497943-61-0
497943610
5NBENZYL7N7NDIETHYL4NITRO213BENZOXADIAZOLE57DIAMINE
CCN(c1cc(NCc2ccccc2)c(c2c1non2)(N+)(=O)(O))CC
CCN(CC)C1=CC(=C(C2=NON=C12)(N+)(=O)(O))NCC3=CC=CC=C3
InChI=1SC17H19N5O3c1321(42)141013(1811128657912)17(22(23)24)1615(14)19252016h51018H3411H212H3
MFCD03301508
N~6~benzylN~4~N~4~diethyl7nitro213benzoxadiazole46diamine
N6BENZYLN4N4DIETHYL7NITRO213BENZOXADIAZOLE46DIAMINE
N6benzylN4N4diethyl7nitrobenzo(c)(125)oxadiazole46diamine
ZINC000004939411
ZINC04939411
ZINC4939411

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Available files

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