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

Systemtic Name: 2-azanyl-1-(4-bromophenyl)-N-[(3,4-dimethoxyphenyl)methyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(4-bromophenyl)-N-[(3,4-dimethoxyphenyl)methyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(4-bromophenyl)-N-[(3,4-dimethoxyphenyl)methyl]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(4-bromophenyl)-N-[(3,4-dimethoxyphenyl)methyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(4-bromophenyl)-N-veratryl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C26H22BrN5O3 MolecularWeight: 532.38858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5=CC=C(C=C5)Br)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5=CC=C(C=C5)Br)N)OC

InChI

InChI=1S/C26H22BrN5O3/c1-34-20-12-7-15(13-21(20)35-2)14-29-26(33)22-23-25(31-19-6-4-3-5-18(19)30-23)32(24(22)28)17-10-8-16(27)9-11-17/h3-13H,14,28H2,1-2H3,(H,29,33)