2-azanyl-1-[(E)-(4-fluorophenyl)methylideneamino]-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-[(E)-(4-fluorophenyl)methylideneamino]-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-[(E)-(4-fluorophenyl)methyleneamino]-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-[(E)-(4-fluorophenyl)methylideneamino]-N-phenethyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-[(E)-(4-fluorophenyl)methylideneamino]-N-phenethylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-[(E)-(4-fluorobenzylidene)amino]-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C26H21FN6O MolecularWeight: 452.482943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC=C(C=C5)F)N

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)/N=C/C5=CC=C(C=C5)F)N

InChI

InChI=1S/C26H21FN6O/c27-19-12-10-18(11-13-19)16-30-33-24(28)22(26(34)29-15-14-17-6-2-1-3-7-17)23-25(33)32-21-9-5-4-8-20(21)31-23/h1-13,16H,14-15,28H2,(H,29,34)/b30-16+