Vitas-M small molecule compound
ethyl 4-{[1-(dicyanomethylidene)-8-methoxy-4,4-dimethyl-2-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-6-yl]methyl}piperazine-1-carboxylate
Catalog ID
STL510608
SMILES CCOC(=O)N1CCN(CC1)CC1=CC(C)(C)N2c3c1cc(OC)cc3C(=C(C#N)C#N)C2=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 C25H27N5O4 MW 461.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O4/c1-5-34-24(32)29-8-6-28(7-9-29)15-16-12-25(2,3)30-22-19(16)10-18(33-4)11-20(22)21(23(30)31)17(13-26)14-27/h10-12H,5-9,15H2,1-4H3InChIKey
CFEDRSIQFXJSHK-UHFFFAOYSA-NSynonyms
134717251
ethyl4((1(dicyanomethylidene)8methoxy44dimethyl2oxo12dihydro4Hpyrrolo(321ij)quinolin6yl)methyl)piperazine1carboxylate
ethyl4((3(dicyanomethylidene)6methoxy1111dimethyl2oxo1azatricyclo(6310^(412))dodeca468(12)9tetraen9yl)methyl)piperazine1carboxylate
InChI=1SC25H27N5O4c153424(32)298628(7929)15161225(23)302219(16)1018(334)1120(22)21(23(30)31)17(1326)1427h1012H5915H214H3
MFCD31711557
ZINC001554503077
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