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

Systemtic Name: 2-azanyl-N-[(4-fluorophenyl)methyl]-1-(phenylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-benzyl-N-[(4-fluorophenyl)methyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-[(4-fluorophenyl)methyl]-1-(phenylmethyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-benzyl-N-[(4-fluorophenyl)methyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-benzyl-N-(4-fluorobenzyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H20FN5O MolecularWeight: 425.457603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC=C(C=C5)F)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC=C(C=C5)F)N

InChI

InChI=1S/C25H20FN5O/c26-18-12-10-16(11-13-18)14-28-25(32)21-22-24(30-20-9-5-4-8-19(20)29-22)31(23(21)27)15-17-6-2-1-3-7-17/h1-13H,14-15,27H2,(H,28,32)