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

Systemtic Name: 2-azanyl-1-[(4-fluorophenyl)methyl]-N-(2-methylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-[(4-fluorophenyl)methyl]-N-isobutyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-[(4-fluorophenyl)methyl]-N-(2-methylpropyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-[(4-fluorophenyl)methyl]-N-(2-methylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(4-fluorobenzyl)-N-isobutyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C22H22FN5O MolecularWeight: 391.441383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=C(C=C4)F)N

Isomeric SMILES

CC(C)CNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=C(C=C4)F)N

InChI

InChI=1S/C22H22FN5O/c1-13(2)11-25-22(29)18-19-21(27-17-6-4-3-5-16(17)26-19)28(20(18)24)12-14-7-9-15(23)10-8-14/h3-10,13H,11-12,24H2,1-2H3,(H,25,29)