Vitas-M small molecule compound

1-{[2-(2-hydroxyethoxy)ethyl]amino}-3-methyl-2-(prop-2-en-1-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile

Catalog ID
STK106581
SMILES C=CCc1c(C)c(C#N)c2n(c1NCCOCCO)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 C20H22N4O2 MW 350.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O2/c1-3-6-15-14(2)16(13-21)20-23-17-7-4-5-8-18(17)24(20)19(15)22-9-11-26-12-10-25/h3-5,7-8,22,25H,1,6,9-12H2,2H3
InChIKey
UYUKHRYEYYSHKH-UHFFFAOYSA-N
Synonyms
612037-70-4
1((2(2HYDROXYETHOXY)ETHYL)AMINO)3METHYL2(PROP2EN1YL)PYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
1(2(2HYDROXYETHOXY)ETHYLAMINO)3METHYL2PROP2ENYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
2ALLYL1((2(2HYDROXYETHOXY)ETHYL)AMINO)3METHYLBENZO(45)IMIDAZO(12A)PYRIDINE4CARBONITRILE
4((2(2HYDROXYETHOXY)ETHYL)AMINO)2METHYL3PROP2ENYL5HYDROPYRIDINO(12A)BENZIMIDAZOLECARBONITRILE
612037704
CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC=C)NCCOCCO)C#N
InChI=1SC20H22N4O2c1361514(2)16(1321)202317745818(17)24(20)19(15)2291126121025h35782225H16912H22H3
MFCD03668201
ZINC000004136890
ZINC04136890
ZINC4136890

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Available files

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