2-azanyl-N-[(4-fluorophenyl)methyl]-1-(indol-3-ylidenemethylamino)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-[(4-fluorophenyl)methyl]-1-(indol-3-ylidenemethylamino)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-[(4-fluorophenyl)methyl]-1-(indol-3-ylidenemethylamino)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-[(4-fluorophenyl)methyl]-1-(3-indolylidenemethylamino)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-[(4-fluorophenyl)methyl]-1-(indol-3-ylidenemethylamino)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-(4-fluorobenzyl)-1-(indol-3-ylidenemethylamino)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C27H20FN7O MolecularWeight: 477.492403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CNN3C(=C(C4=NC5=CC=CC=C5N=C43)C(=O)NCC6=CC=C(C=C6)F)N)C=N2

Isomeric SMILES

C1=CC=C2C(=C1)C(=CNN3C(=C(C4=NC5=CC=CC=C5N=C43)C(=O)NCC6=CC=C(C=C6)F)N)C=N2

InChI

InChI=1S/C27H20FN7O/c28-18-11-9-16(10-12-18)13-31-27(36)23-24-26(34-22-8-4-3-7-21(22)33-24)35(25(23)29)32-15-17-14-30-20-6-2-1-5-19(17)20/h1-12,14-15,32H,13,29H2,(H,31,36)