Vitas-M small molecule compound

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

Catalog ID
STK533461
SMILES CCCCNC(=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 C22H21N5O3 MW 403.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O3/c1-2-3-10-24-22(28)18-19-21(26-15-7-5-4-6-14(15)25-19)27(20(18)23)13-8-9-16-17(11-13)30-12-29-16/h4-9,11H,2-3,10,12,23H2,1H3,(H,24,28)
InChIKey
CXGDSDIKNKBSAF-UHFFFAOYSA-N
Synonyms

2amino1(13benzodioxol5yl)Nbutyl1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1(13BENZODIOXOL5YL)NBUTYLPYRROLO(32B)QUINOXALINE3CARBOXAMIDE
2amino1(benzo(d)(13)dioxol5yl)Nbutyl1Hpyrrolo(23b)quinoxaline3carboxamide
CCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC5=C(C=C4)OCO5)N
InChI=1SC22H21N5O3c123102422(28)181921(2615754614(15)2519)27(20(18)23)13891617(1113)30122916h4911H23101223H21H3(H2428)
MFCD02164500
ZINC000002291729
ZINC02291729
ZINC2291729

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Available files

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