Vitas-M small molecule compound
4-(4-methylpiperazin-1-yl)-3-nitrobenzonitrile
Catalog ID
STL169178
SMILES N#Cc1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)C
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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 C12H14N4O2 MW 246.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N4O2/c1-14-4-6-15(7-5-14)11-3-2-10(9-13)8-12(11)16(17)18/h2-3,8H,4-7H2,1H3InChIKey
FTXUQLQDIMEMQN-UHFFFAOYSA-NSynonyms
864718-33-24(4methylpiperazin1yl)3nitrobenzonitrile
864718332
CN1CCN(CC1)C2=C(C=C(C=C2)C#N)(N+)(=O)(O)
InChI=1SC12H14N4O2c1144615(7514)113210(913)812(11)16(17)18h238H47H21H3
MFCD03991945
N#Cc1ccc(c(c1)(N+)(=O)(O))N1CCN(CC1)C
ZINC000004754733
ZINC4754733
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