Vitas-M small molecule compound

1,3-bis(4-nitrobenzyl)quinazoline-2,4(1H,3H)-dione

Catalog ID
STK279525
SMILES [O-][N+](=O)c1ccc(cc1)Cn1c(=O)n(Cc2ccc(cc2)[N+](=O)[O-])c2c(c1=O)cccc2

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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 C22H16N4O6 MW 432.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4O6/c27-21-19-3-1-2-4-20(19)23(13-15-5-9-17(10-6-15)25(29)30)22(28)24(21)14-16-7-11-18(12-8-16)26(31)32/h1-12H,13-14H2
InChIKey
DJCBVDUXZIBPKG-UHFFFAOYSA-N
Synonyms
332383-06-9
(O)(N+)(=O)c1ccc(cc1)Cn1c(=O)n(Cc2ccc(cc2)(N+)(=O)(O))c2c(c1=O)cccc2
13BIS((4NITROPHENYL)METHYL)13DIHYDROQUINAZOLINE24DIONE
13BIS((4NITROPHENYL)METHYL)QUINAZOLINE24DIONE
13BIS(4NITROBENZYL)1HQUINAZOLINE24DIONE
13BIS(4NITROBENZYL)QUINAZOLINE24(1H3H)DIONE
332383069
C1=CC=C2C(=C1)C(=O)N(C(=O)N2CC3=CC=C(C=C3)(N+)(=O)(O))CC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC22H16N4O6c272119312420(19)23(13155917(10615)25(29)30)22(28)24(21)141671118(12816)26(31)32h112H1314H2
MFCD00468662
ZINC000003165941
ZINC03165941
ZINC3165941

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Available files

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