Vitas-M small molecule compound

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

Catalog ID
STK528827
SMILES [O-][N+](=O)c1c(NCc2ccccc2)cc(c2c1non2)NC1CCCCC1

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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 C19H21N5O3 MW 367.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N5O3/c25-24(26)19-16(20-12-13-7-3-1-4-8-13)11-15(17-18(19)23-27-22-17)21-14-9-5-2-6-10-14/h1,3-4,7-8,11,14,20-21H,2,5-6,9-10,12H2
InChIKey
NZUBIEFKKSPSCQ-UHFFFAOYSA-N
Synonyms
372500-82-8
(O)(N+)(=O)c1c(NCc2ccccc2)cc(c2c1non2)NC1CCCCC1
372500828
5NBENZYL7NCYCLOHEXYL4NITRO213BENZOXADIAZOLE57DIAMINE
C1CCC(CC1)NC2=CC(=C(C3=NON=C23)(N+)(=O)(O))NCC4=CC=CC=C4
InChI=1SC19H21N5O3c2524(26)1916(2012137314813)1115(1718(19)23272217)211495261014h1347811142021H25691012H2
MFCD01943974
N~6~benzylN~4~cyclohexyl7nitro213benzoxadiazole46diamine
N6BENZYLN4CYCLOHEXYL7NITRO213BENZOXADIAZOLE46DIAMINE
N6benzylN4cyclohexyl7nitrobenzo(c)(125)oxadiazole46diamine
ZINC000004844315
ZINC04844315
ZINC4844315

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Available files

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