Vitas-M small molecule compound

3-methyl-1-[4-(4-methylphenyl)piperazin-1-yl]-2-(prop-2-en-1-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile

Catalog ID
STL357373
SMILES C=CCc1c(C)c(C#N)c2n(c1N1CCN(CC1)c1ccc(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 C27H27N5 MW 421.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5/c1-4-7-22-20(3)23(18-28)26-29-24-8-5-6-9-25(24)32(26)27(22)31-16-14-30(15-17-31)21-12-10-19(2)11-13-21/h4-6,8-13H,1,7,14-17H2,2-3H3
InChIKey
FOTHVGQXWZPQDS-UHFFFAOYSA-N
Synonyms
850186-50-4
2allyl3methyl1(4(ptolyl)piperazin1yl)benzo(45)imidazo(12a)pyridine4carbonitrile
2METHYL4(4(4METHYLPHENYL)PIPERAZINYL)3PROP2ENYL5HYDROPYRIDINO(12A)BENZIMIDAZOLECARBONITRILE
3methyl1(4(4methylphenyl)piperazin1yl)2(prop2en1yl)pyrido(12a)benzimidazole4carbonitrile
3METHYL1(4(4METHYLPHENYL)PIPERAZIN1YL)2PROP2ENYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
850186504
CC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=C(C4=NC5=CC=CC=C5N34)C#N)C)CC=C
InChI=1SC27H27N5c1472220(3)23(1828)262924856925(24)32(26)27(22)31161430(151731)21121019(2)111321h46813H171417H223H3
MFCD04402884
ZINC000005455769
ZINC05455769
ZINC5455769

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Available files

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