Vitas-M small molecule compound

methyl 3-[4-cyano-3-methyl-1-(pyrrolidin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate

Catalog ID
STK953456
SMILES COC(=O)CCc1c(C)c(C#N)c2n(c1N1CCCC1)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 C21H22N4O2 MW 362.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O2/c1-14-15(9-10-19(26)27-2)21(24-11-5-6-12-24)25-18-8-4-3-7-17(18)23-20(25)16(14)13-22/h3-4,7-8H,5-6,9-12H2,1-2H3
InChIKey
RASDSONMEOLGGU-UHFFFAOYSA-N
Synonyms
844859-78-5
844859785
CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(=O)OC)N4CCCC4)C#N
InChI=1SC21H22N4O2c11415(91019(26)272)21(2411561224)2518843717(18)2320(25)16(14)1322h3478H56912H212H3
METHYL3(4CYANO3METHYL1(PYRROLIDIN1YL)BENZO(45)IMIDAZO(12A)PYRIDIN2YL)PROPANOATE
methyl3(4cyano3methyl1(pyrrolidin1yl)pyrido(12a)benzimidazol2yl)propanoate
METHYL3(4CYANO3METHYL1PYRROLIDIN1YLPYRIDO(12A)BENZIMIDAZOL2YL)PROPANOATE
METHYL3(4CYANO3METHYL1PYRROLIDINYL10HYDROPYRIDINO(12A)BENZIMIDAZOL2YL)PROPANOATE
MFCD04165334
ZINC000004039865
ZINC04039865
ZINC4039865

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Available files

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