2-azanyl-1-(3,5-dimethylphenyl)-N-(4-phenylbutan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(3,5-dimethylphenyl)-N-(4-phenylbutan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(3,5-dimethylphenyl)-N-(1-methyl-3-phenyl-propyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(3,5-dimethylphenyl)-N-(4-phenylbutan-2-yl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(3,5-dimethylphenyl)-N-(4-phenylbutan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(3,5-dimethylphenyl)-N-(1-methyl-3-phenyl-propyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C29H29N5O MolecularWeight: 463.57346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NC(C)CCC5=CC=CC=C5)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NC(C)CCC5=CC=CC=C5)N)C

InChI

InChI=1S/C29H29N5O/c1-18-15-19(2)17-22(16-18)34-27(30)25(26-28(34)33-24-12-8-7-11-23(24)32-26)29(35)31-20(3)13-14-21-9-5-4-6-10-21/h4-12,15-17,20H,13-14,30H2,1-3H3,(H,31,35)