2-azanyl-1-[(E)-(3-bromophenyl)methylideneamino]-N-cyclopentyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-[(E)-(3-bromophenyl)methylideneamino]-N-cyclopentyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-[(E)-(3-bromophenyl)methyleneamino]-N-cyclopentyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-[(E)-(3-bromophenyl)methylideneamino]-N-cyclopentyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-[(E)-(3-bromophenyl)methylideneamino]-N-cyclopentylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-[(E)-(3-bromobenzylidene)amino]-N-cyclopentyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C23H21BrN6O MolecularWeight: 477.35644

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC(=CC=C5)Br)N

Isomeric SMILES

C1CCC(C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)/N=C/C5=CC(=CC=C5)Br)N

InChI

InChI=1S/C23H21BrN6O/c24-15-7-5-6-14(12-15)13-26-30-21(25)19(23(31)27-16-8-1-2-9-16)20-22(30)29-18-11-4-3-10-17(18)28-20/h3-7,10-13,16H,1-2,8-9,25H2,(H,27,31)/b26-13+