Vitas-M small molecule compound

3-methyl-1-[(4-methylphenyl)amino]-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile

Catalog ID
STK531236
SMILES CCCCCCCCc1c(C)c(C#N)c2n(c1Nc1ccc(cc1)C)c1ccccc1n2

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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 C28H32N4 MW 424.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4/c1-4-5-6-7-8-9-12-23-21(3)24(19-29)28-31-25-13-10-11-14-26(25)32(28)27(23)30-22-17-15-20(2)16-18-22/h10-11,13-18,30H,4-9,12H2,1-3H3
InChIKey
PLHQPDCORQTACY-UHFFFAOYSA-N
Synonyms

3methyl1((4methylphenyl)amino)2octylpyrido(12a)benzimidazole4carbonitrile
3METHYL1(4METHYLANILINO)2OCTYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
3methyl2octyl1(ptolylamino)benzo(45)imidazo(12a)pyridine4carbonitrile
CCCCCCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NC4=CC=C(C=C4)C
InChI=1SC28H32N4c1456789122321(3)24(1929)2831251310111426(25)32(28)27(23)3022171520(2)161822h1011131830H4912H213H3
MFCD01912710
ZINC000050704703
ZINC50704703

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Available files

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