Vitas-M small molecule compound

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

Catalog ID
STK714520
SMILES Clc1cccc(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 C23H21ClN6O2 MW 448.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN6O2/c24-15-6-3-5-14(11-15)12-27-30-21(25)19(23(31)26-13-16-7-4-10-32-16)20-22(30)29-18-9-2-1-8-17(18)28-20/h1-3,5-6,8-9,11-12,16H,4,7,10,13,25H2,(H,26,31)/b27-12+
InChIKey
CZGFYCZMDNSOLG-KKMKTNMSSA-N
Synonyms
836650-61-4
(E)2amino1((3chlorobenzylidene)amino)N((tetrahydrofuran2yl)methyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(3chlorophenyl)methylidene)amino)N(tetrahydrofuran2ylmethyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1((E)(3chlorophenyl)methylideneamino)N(oxolan2ylmethyl)pyrrolo(32b)quinoxaline3carboxamide
836650614
C1CC(OC1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC(=CC=C5)Cl)N
Clc1cccc(c1)C=Nn1c2nc3ccccc3nc2c(c1N)C(=O)NCC1CCCO1
InChI=1SC23H21ClN6O2c241563514(1115)12273021(25)19(23(31)26131674103216)2022(30)2918921817(18)2820h135689111216H47101325H2(H2631)b2712+
MFCD03692134
ZINC000002253797
ZINC000002253799

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Available files

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