Vitas-M small molecule compound

butyl 2-amino-1-(1,3-benzodioxol-5-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate

Catalog ID
STL237523
SMILES CCCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc2c(c1)OCO2

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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 C22H20N4O4 MW 404.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O4/c1-2-3-10-28-22(27)18-19-21(25-15-7-5-4-6-14(15)24-19)26(20(18)23)13-8-9-16-17(11-13)30-12-29-16/h4-9,11H,2-3,10,12,23H2,1H3
InChIKey
NBWJKQANOMNSQQ-UHFFFAOYSA-N
Synonyms
498569-83-8
498569838
butyl2amino1(13benzodioxol5yl)1Hpyrrolo(23b)quinoxaline3carboxylate
BUTYL2AMINO1(13BENZODIOXOL5YL)PYRROLO(32B)QUINOXALINE3CARBOXYLATE
butyl2amino1(benzo(d)(13)dioxol5yl)1Hpyrrolo(23b)quinoxaline3carboxylate
CCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC5=C(C=C4)OCO5)N
InChI=1SC22H20N4O4c123102822(27)181921(2515754614(15)2419)26(20(18)23)13891617(1113)30122916h4911H23101223H21H3
MFCD03302098
ZINC000002349910
ZINC02349910
ZINC2349910

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Available files

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