butyl 2-[[4-(2-azanyl-3-cyano-pyrrolo[3,2-b]quinoxalin-1-yl)phenyl]carbonylamino]ethanoate

Systemtic Name: butyl 2-[[4-(2-azanyl-3-cyano-pyrrolo[3,2-b]quinoxalin-1-yl)phenyl]carbonylamino]ethanoate Openeye Name: butyl 2-[[4-(2-amino-3-cyano-pyrrolo[3,2-b]quinoxalin-1-yl)benzoyl]amino]acetate CAS Name: 2-[[[4-(2-amino-3-cyano-1-pyrrolo[3,2-b]quinoxalinyl)phenyl]-oxomethyl]amino]acetic acid butyl ester IUPAC Name: butyl 2-[[4-(2-amino-3-cyanopyrrolo[3,2-b]quinoxalin-1-yl)benzoyl]amino]acetate Traditional Name: 2-[[4-(2-amino-3-cyano-pyrrolo[3,2-b]quinoxalin-1-yl)benzoyl]amino]acetic acid butyl ester Formula: C24H22N6O3 MolecularWeight: 442.46988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CNC(=O)C1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)N

Isomeric SMILES

CCCCOC(=O)CNC(=O)C1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)N

InChI

InChI=1S/C24H22N6O3/c1-2-3-12-33-20(31)14-27-24(32)15-8-10-16(11-9-15)30-22(26)17(13-25)21-23(30)29-19-7-5-4-6-18(19)28-21/h4-11H,2-3,12,14,26H2,1H3,(H,27,32)