Vitas-M small molecule compound

2-butyl-3-methyl-1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile

Catalog ID
STK107775
SMILES CCCCc1c(C)c(C#N)c2n(c1N1CCN(CC1)Cc1cccc3c1cccc3)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 C32H33N5 MW 487.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33N5/c1-3-4-13-26-23(2)28(21-33)31-34-29-15-7-8-16-30(29)37(31)32(26)36-19-17-35(18-20-36)22-25-12-9-11-24-10-5-6-14-27(24)25/h5-12,14-16H,3-4,13,17-20,22H2,1-2H3
InChIKey
DXDCHIUNAVRRNW-UHFFFAOYSA-N
Synonyms
497942-39-9
2butyl3methyl1(4(naphthalen1ylmethyl)piperazin1yl)benzo(45)imidazo(12a)pyridine4carbonitrile
2BUTYL3METHYL1(4(NAPHTHALEN1YLMETHYL)PIPERAZIN1YL)PYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
3BUTYL2METHYL4(4(NAPHTHYLMETHYL)PIPERAZINYL)5HYDROPYRIDINO(12A)BENZIMIDAZOLECARBONITRILE
497942399
CCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4CCN(CC4)CC5=CC=CC6=CC=CC=C65
InChI=1SC32H33N5c134132623(2)28(2133)31342915781630(29)37(31)32(26)36191735(182036)2225129112410561427(24)25h5121416H3413172022H212H3
MFCD03301393
ZINC000019808413
ZINC19808413

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Available files

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