Vitas-M small molecule compound

11-(1,3-benzodioxol-5-ylmethyl)-3-(butan-2-yl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

Catalog ID
STL338397
SMILES CCC(n1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccc2c(c1)OCO2)C

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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 C25H23N5O3 MW 441.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O3/c1-4-14(2)30-15(3)26-23-21(25(30)31)22-24(28-18-8-6-5-7-17(18)27-22)29(23)12-16-9-10-19-20(11-16)33-13-32-19/h5-11,14H,4,12-13H2,1-3H3
InChIKey
WTKXJPKQLUDZQV-UHFFFAOYSA-N
Synonyms
836639-15-7
11(13benzodioxol5ylmethyl)3(butan2yl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(benzo(d)(13)dioxol5ylmethyl)3(secbutyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
836639157
CCC(C)N1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2CC5=CC6=C(C=C5)OCO6)C
InChI=1SC25H23N5O3c1414(2)3015(3)262321(25(30)31)2224(2818865717(18)2722)29(23)12169101920(1116)33133219h51114H41213H213H3
MFCD03690251
ZINC000002251243
ZINC000002251244

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Available files

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