Vitas-M small molecule compound
N-[(2E)-1-butyl-3-cyano-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-2-ylidene]-1,3-benzodioxole-5-carboxamide
Catalog ID
STK635583
SMILES CCCCn1/c(=N/C(=O)c2ccc3c(c2)OCO3)/c(C#N)cc2c1nc1c(C)cccn1c2=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 C25H21N5O4 MW 455.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O4/c1-3-4-9-29-22(28-24(31)16-7-8-19-20(12-16)34-14-33-19)17(13-26)11-18-23(29)27-21-15(2)6-5-10-30(21)25(18)32/h5-8,10-12H,3-4,9,14H2,1-2H3/b28-22+InChIKey
UTNRNTSOUAOTMB-XAYXJRQQSA-NSynonyms
850763-02-9(E)N(1butyl3cyano10methyl5oxo1Hdipyrido(12a23d)pyrimidin2(5H)ylidene)benzo(d)(13)dioxole5carboxamide
850763029
CCCCn1c(=NC(=O)c2ccc3c(c2)OCO3)c(C#N)cc2c1nc1c(C)cccn1c2=O
MFCD05695074
N((2E)1butyl3cyano10methyl5oxo15dihydro2Hdipyrido(12a23d)pyrimidin2ylidene)13benzodioxole5carboxamide
ZINC000031936881
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