Vitas-M small molecule compound

2-butyl-1-{4-[2-(2,5-dimethyl-1H-pyrrol-1-yl)ethyl]piperazin-1-yl}-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile

Catalog ID
STK106253
SMILES CCCCc1c(C)c(C#N)c2n(c1N1CCN(CC1)CCn1c(C)ccc1C)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 C29H36N6 MW 468.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H36N6/c1-5-6-9-24-23(4)25(20-30)28-31-26-10-7-8-11-27(26)35(28)29(24)33-17-14-32(15-18-33)16-19-34-21(2)12-13-22(34)3/h7-8,10-13H,5-6,9,14-19H2,1-4H3
InChIKey
PQDRCVJEJHBKEL-UHFFFAOYSA-N
Synonyms
442572-87-4
2butyl1(4(2(25dimethyl1Hpyrrol1yl)ethyl)piperazin1yl)3methylbenzo(45)imidazo(12a)pyridine4carbonitrile
2BUTYL1(4(2(25DIMETHYL1HPYRROL1YL)ETHYL)PIPERAZIN1YL)3METHYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
2BUTYL1(4(2(25DIMETHYLPYRROL1YL)ETHYL)PIPERAZIN1YL)3METHYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
4(4(2(25DIMETHYLPYRROLYL)ETHYL)PIPERAZINYL)3BUTYL2METHYL5HYDROPYRIDINO(12A)BENZIMIDAZOLECARBONITRILE
442572874
CCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4CCN(CC4)CCN5C(=CC=C5C)C
InChI=1SC29H36N6c15692423(4)25(2030)28312610781127(26)35(28)29(24)33171432(151833)16193421(2)121322(34)3h781013H5691419H214H3
MFCD03294141
ZINC000020080782
ZINC20080782

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.