Vitas-M small molecule compound

N-[(2E)-3-cyano-1-(3-ethoxypropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-2-ylidene]-4-ethoxybenzamide

Catalog ID
STK872811
SMILES CCOCCCn1/c(=N/C(=O)c2ccc(cc2)OCC)/c(C#N)cc2c1nc1ccccn1c2=O

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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 C26H25N5O4 MW 471.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O4/c1-3-34-15-7-14-31-23(29-25(32)18-9-11-20(12-10-18)35-4-2)19(17-27)16-21-24(31)28-22-8-5-6-13-30(22)26(21)33/h5-6,8-13,16H,3-4,7,14-15H2,1-2H3/b29-23+
InChIKey
UWPKBBDZNQOVOA-BYNJWEBRSA-N
Synonyms
845983-61-1
(E)N(3cyano1(3ethoxypropyl)5oxo1Hdipyrido(12a23d)pyrimidin2(5H)ylidene)4ethoxybenzamide
845983611
CCOCCCn1c(=NC(=O)c2ccc(cc2)OCC)c(C#N)cc2c1nc1ccccn1c2=O
MFCD04171219
N((2E)3cyano1(3ethoxypropyl)5oxo15dihydro2Hdipyrido(12a23d)pyrimidin2ylidene)4ethoxybenzamide
ZINC000009223000

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Available files

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