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

Systemtic Name: 2-azanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-homoveratryl-1-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C27H25N5O3 MolecularWeight: 467.5191

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25N5O3/c1-34-21-13-12-17(16-22(21)35-2)14-15-29-27(33)23-24-26(31-20-11-7-6-10-19(20)30-24)32(25(23)28)18-8-4-3-5-9-18/h3-13,16H,14-15,28H2,1-2H3,(H,29,33)