Vitas-M small molecule compound
N~6~-benzyl-N~4~,N~4~-dibutyl-7-nitro-2,1,3-benzoxadiazole-4,6-diamine
Catalog ID
STK541877
SMILES CCCCN(c1cc(NCc2ccccc2)c(c2c1non2)[N+](=O)[O-])CCCC
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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 C21H27N5O3 MW 397.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O3/c1-3-5-12-25(13-6-4-2)18-14-17(22-15-16-10-8-7-9-11-16)21(26(27)28)20-19(18)23-29-24-20/h7-11,14,22H,3-6,12-13,15H2,1-2H3InChIKey
MHOPYAYIPHGAFA-UHFFFAOYSA-NSynonyms
488840-90-0488840900
5NBENZYL7N7NDIBUTYL4NITRO213BENZOXADIAZOLE57DIAMINE
CCCCN(c1cc(NCc2ccccc2)c(c2c1non2)(N+)(=O)(O))CCCC
CCCCN(CCCC)C1=CC(=C(C2=NON=C12)(N+)(=O)(O))NCC3=CC=CC=C3
InChI=1SC21H27N5O3c1351225(13642)181417(221516108791116)21(26(27)28)2019(18)23292420h7111422H36121315H212H3
MFCD03294266
N~6~benzylN~4~N~4~dibutyl7nitro213benzoxadiazole46diamine
N6BENZYLN4N4DIBUTYL7NITRO213BENZOXADIAZOLE46DIAMINE
N6benzylN4N4dibutyl7nitrobenzo(c)(125)oxadiazole46diamine
ZINC000004889150
ZINC04889150
ZINC4889150
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