2-azanyl-1-(3-chloranyl-4-fluoranyl-phenyl)-N-(4-phenylbutan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(3-chloranyl-4-fluoranyl-phenyl)-N-(4-phenylbutan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(3-chloro-4-fluoro-phenyl)-N-(1-methyl-3-phenyl-propyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(3-chloro-4-fluorophenyl)-N-(4-phenylbutan-2-yl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(3-chloro-4-fluorophenyl)-N-(4-phenylbutan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(3-chloro-4-fluoro-phenyl)-N-(1-methyl-3-phenyl-propyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C27H23ClFN5O MolecularWeight: 487.955823

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5=CC(=C(C=C5)F)Cl)N

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5=CC(=C(C=C5)F)Cl)N

InChI

InChI=1S/C27H23ClFN5O/c1-16(11-12-17-7-3-2-4-8-17)31-27(35)23-24-26(33-22-10-6-5-9-21(22)32-24)34(25(23)30)18-13-14-20(29)19(28)15-18/h2-10,13-16H,11-12,30H2,1H3,(H,31,35)