Vitas-M small molecule compound
5-amino-3-{(Z)-1-cyano-2-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]ethenyl}-1-phenyl-1H-pyrazole-4-carbonitrile
Catalog ID
STK758057
SMILES N#C/C(=C\c1cccn1c1ccc(cc1)[N+](=O)[O-])/c1nn(c(c1C#N)N)c1ccccc1
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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 C23H15N7O2 MW 421.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15N7O2/c24-14-16(22-21(15-25)23(26)29(27-22)18-5-2-1-3-6-18)13-20-7-4-12-28(20)17-8-10-19(11-9-17)30(31)32/h1-13H,26H2/b16-13+InChIKey
ZJIHFYIJTHTTCT-DTQAZKPQSA-NSynonyms
5amino3((Z)1cyano2(1(4nitrophenyl)1Hpyrrol2yl)ethenyl)1phenyl1Hpyrazole4carbonitrile
5AMINO3((Z)1CYANO2(1(4NITROPHENYL)PYRROL2YL)ETHENYL)1PHENYLPYRAZOLE4CARBONITRILE
C1=CC=C(C=C1)N2C(=C(C(=N2)C(=CC3=CC=CN3C4=CC=C(C=C4)(N+)(=O)(O))C#N)C#N)N
InChI=1SC23H15N7O2c241416(2221(1525)23(26)29(2722)185213618)1320741228(20)1781019(11917)30(31)32h113H26H2b1613+
MFCD01161036
N#CC(=Cc1cccn1c1ccc(cc1)(N+)(=O)(O))c1nn(c(c1C#N)N)c1ccccc1
ZINC000012377086
ZINC12377086
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