Vitas-M small molecule compound
4-nitro-5-[4-(4-nitrophenyl)piperazin-1-yl]benzene-1,2-dicarbonitrile
Catalog ID
STK779805
SMILES N#Cc1cc(N2CCN(CC2)c2ccc(cc2)[N+](=O)[O-])c(cc1C#N)[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 C18H14N6O4 MW 378.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N6O4/c19-11-13-9-17(18(24(27)28)10-14(13)12-20)22-7-5-21(6-8-22)15-1-3-16(4-2-15)23(25)26/h1-4,9-10H,5-8H2InChIKey
NQUUKPBQLFQFBI-UHFFFAOYSA-NSynonyms
4nitro5(4(4nitrophenyl)piperazin1yl)benzene12dicarbonitrile
C1CN(CCN1C2=CC=C(C=C2)(N+)(=O)(O))C3=C(C=C(C(=C3)C#N)C#N)(N+)(=O)(O)
InChI=1SC18H14N6O4c191113917(18(24(27)28)1014(13)1220)227521(6822)151316(4215)23(25)26h14910H58H2
MFCD05859251
N#Cc1cc(N2CCN(CC2)c2ccc(cc2)(N+)(=O)(O))c(cc1C#N)(N+)(=O)(O)
ZINC000004593490
ZINC04593490
ZINC4593490
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