Vitas-M small molecule compound

1-benzyl-2-{(2E)-2-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1H-benzimidazole

Catalog ID
STK014449
SMILES [O-][N+](=O)c1cc2OCOc2cc1/C=N/Nc1nc2c(n1Cc1ccccc1)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 C22H17N5O4 MW 415.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N5O4/c28-27(29)19-11-21-20(30-14-31-21)10-16(19)12-23-25-22-24-17-8-4-5-9-18(17)26(22)13-15-6-2-1-3-7-15/h1-12H,13-14H2,(H,24,25)/b23-12+
InChIKey
DGWBLPXBEZYOSM-FSJBWODESA-N
Synonyms
443780-78-7
(O)(N+)(=O)c1cc2OCOc2cc1C=NNc1nc2c(n1Cc1ccccc1)cccc2
1BENZYL2((2E)2((6NITRO13BENZODIOXOL5YL)METHYLIDENE)HYDRAZINYL)1HBENZIMIDAZOLE
1benzylN((E)(6nitro13benzodioxol5yl)methylideneamino)benzimidazol2amine
443780787
C1OC2=C(O1)C=C(C(=C2)C=NNC3=NC4=CC=CC=C4N3CC5=CC=CC=C5)(N+)(=O)(O)
InChI=1SC22H17N5O4c2827(29)19112120(30143121)1016(19)122325222417845918(17)26(22)13156213715h112H1314H2(H2425)b2312+
MFCD03616989
STK014449
ZINC000004551797
ZINC34861529

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Available files

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