Vitas-M small molecule compound

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

Catalog ID
STK103269
SMILES C=CCc1c(C)c(C#N)c2n(c1Nc1ccc(cc1)CCCC)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 C26H26N4 MW 394.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4/c1-4-6-10-19-13-15-20(16-14-19)28-25-21(9-5-2)18(3)22(17-27)26-29-23-11-7-8-12-24(23)30(25)26/h5,7-8,11-16,28H,2,4,6,9-10H2,1,3H3
InChIKey
QMVJIJRBTGFIRT-UHFFFAOYSA-N
Synonyms
612037-69-1
(1Z)1((4BUTYLPHENYL)IMINO)3METHYL2(PROP2EN1YL)15DIHYDROPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
1((4BUTYLPHENYL)AMINO)3METHYL2(PROP2EN1YL)PYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
1(4BUTYLANILINO)3METHYL2PROP2ENYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
2allyl1((4butylphenyl)amino)3methylbenzo(45)imidazo(12a)pyridine4carbonitrile
4((4BUTYLPHENYL)AMINO)2METHYL3PROP2ENYL5HYDROPYRIDINO(12A)BENZIMIDAZOLECARBONITRILE
612037691
CCCCC1=CC=C(C=C1)NC2=C(C(=C(C3=NC4=CC=CC=C4N23)C#N)C)CC=C
InChI=1SC26H26N4c1461019131520(161419)282521(952)18(3)22(1727)26292311781224(23)30(25)26h578111628H246910H213H3
MFCD04126713
ZINC000006241034
ZINC06241034
ZINC101328250
ZINC6241034

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Available files

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