2-azanyl-1-(4-bromophenyl)-N-(phenylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(4-bromophenyl)-N-(phenylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-benzyl-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(4-bromophenyl)-N-(phenylmethyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-benzyl-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-benzyl-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C24H18BrN5O MolecularWeight: 472.33662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5=CC=C(C=C5)Br)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5=CC=C(C=C5)Br)N

InChI

InChI=1S/C24H18BrN5O/c25-16-10-12-17(13-11-16)30-22(26)20(24(31)27-14-15-6-2-1-3-7-15)21-23(30)29-19-9-5-4-8-18(19)28-21/h1-13H,14,26H2,(H,27,31)