Vitas-M small molecule compound
2-amino-1-{[(E)-(4-fluorophenyl)methylidene]amino}-N-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Catalog ID
STK920616
SMILES CC(CNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(cc1)F)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 C22H21FN6O MW 404.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21FN6O/c1-13(2)11-25-22(30)18-19-21(28-17-6-4-3-5-16(17)27-19)29(20(18)24)26-12-14-7-9-15(23)10-8-14/h3-10,12-13H,11,24H2,1-2H3,(H,25,30)/b26-12+InChIKey
RFTTUFWXPKRKON-RPPGKUMJSA-NSynonyms
836626-23-4(E)2amino1((4fluorobenzylidene)amino)Nisobutyl1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(4fluorophenyl)methylidene)amino)N(2methylpropyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1((E)(4fluorophenyl)methylideneamino)N(2methylpropyl)pyrrolo(32b)quinoxaline3carboxamide
836626234
CC(C)CNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC=C(C=C4)F)N
CC(CNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1ccc(cc1)F)C
InChI=1SC22H21FN6Oc113(2)112522(30)181921(2817643516(17)2719)29(20(18)24)2612147915(23)10814h3101213H1124H212H3(H2530)b2612+
MFCD03688242
ZINC000005030790
ZINC34829138
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