Vitas-M small molecule compound

2-amino-1-{[(E)-(3-hydroxyphenyl)methylidene]amino}-N-(tetrahydrofuran-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STL226102
SMILES Oc1cccc(c1)/C=N/n1c2nc3ccccc3nc2c(c1N)C(=O)NCC1CCCO1

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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 C23H22N6O3 MW 430.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N6O3/c24-21-19(23(31)25-13-16-7-4-10-32-16)20-22(28-18-9-2-1-8-17(18)27-20)29(21)26-12-14-5-3-6-15(30)11-14/h1-3,5-6,8-9,11-12,16,30H,4,7,10,13,24H2,(H,25,31)/b26-12+
InChIKey
TWPKALKFWOLMHP-RPPGKUMJSA-N
Synonyms
835910-62-8
(E)2amino1((3hydroxybenzylidene)amino)N((tetrahydrofuran2yl)methyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(3hydroxyphenyl)methylidene)amino)N(tetrahydrofuran2ylmethyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1((E)(3hydroxyphenyl)methylideneamino)N(oxolan2ylmethyl)pyrrolo(32b)quinoxaline3carboxamide
835910628
C1CC(OC1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC(=CC=C5)O)N
InChI=1SC23H22N6O3c242119(23(31)25131674103216)2022(2818921817(18)2720)29(21)26121453615(30)1114h13568911121630H47101324H2(H2531)b2612+
MFCD03687246
Oc1cccc(c1)C=Nn1c2nc3ccccc3nc2c(c1N)C(=O)NCC1CCCO1
ZINC000002249551
ZINC000002249553

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Available files

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