Vitas-M small molecule compound

1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-methyl-2-pentylpyrido[1,2-a]benzimidazole-4-carbonitrile

Catalog ID
STK108024
SMILES CCCCCc1c(C)c(C#N)c2n(c1NCCc1ccc(c(c1)OC)OC)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 C28H32N4O2 MW 456.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O2/c1-5-6-7-10-21-19(2)22(18-29)28-31-23-11-8-9-12-24(23)32(28)27(21)30-16-15-20-13-14-25(33-3)26(17-20)34-4/h8-9,11-14,17,30H,5-7,10,15-16H2,1-4H3
InChIKey
LREHYXREGDTBCK-UHFFFAOYSA-N
Synonyms
442572-60-3
1((2(34DIMETHOXYPHENYL)ETHYL)AMINO)3METHYL2PENTYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
1((34dimethoxyphenethyl)amino)3methyl2pentylbenzo(45)imidazo(12a)pyridine4carbonitrile
1(2(34DIMETHOXYPHENYL)ETHYLAMINO)3METHYL2PENTYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
4((2(34DIMETHOXYPHENYL)ETHYL)AMINO)2METHYL3PENTYL5HYDROPYRIDINO(12A)BENZIMIDAZOLECARBONITRILE
442572603
CCCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NCCC4=CC(=C(C=C4)OC)OC
InChI=1SC28H32N4O2c1567102119(2)22(1829)28312311891224(23)32(28)27(21)30161520131425(333)26(1720)344h8911141730H57101516H214H3
MFCD03416989
ZINC000005354701
ZINC05354701
ZINC5354701

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Available files

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