Vitas-M small molecule compound
2-{[2-(1H-imidazol-4-yl)ethyl]amino}-5-nitrobenzonitrile
Catalog ID
STK262057
SMILES N#Cc1cc(ccc1NCCc1c[nH]cn1)[N+](=O)[O-]
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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 C12H11N5O2 MW 257.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N5O2/c13-6-9-5-11(17(18)19)1-2-12(9)15-4-3-10-7-14-8-16-10/h1-2,5,7-8,15H,3-4H2,(H,14,16)InChIKey
KYUYYZBYQKEQPH-UHFFFAOYSA-NSynonyms
2((2(1Himidazol4yl)ethyl)amino)5nitrobenzonitrile
2((2IMIDAZOL4YLETHYL)AMINO)5NITROBENZENECARBONITRILE
2(2(1Himidazol5yl)ethylamino)5nitrobenzonitrile
C1=CC(=C(C=C1(N+)(=O)(O))C#N)NCCC2=CN=CN2
InChI=1SC12H11N5O2c1369511(17(18)19)1212(9)15431071481610h1257815H34H2(H1416)
MFCD08547670
N#Cc1cc(ccc1NCCc1c(nH)cn1)(N+)(=O)(O)
ZINC000008701310
ZINC8701310
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