2-azanyl-1-(4-butoxyphenyl)-N-(3-methylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(4-butoxyphenyl)-N-(3-methylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(4-butoxyphenyl)-N-(m-tolyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(4-butoxyphenyl)-N-(3-methylphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(4-butoxyphenyl)-N-(3-methylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(4-butoxyphenyl)-N-(m-tolyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C28H27N5O2 MolecularWeight: 465.54628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NC5=CC=CC(=C5)C)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NC5=CC=CC(=C5)C)N

InChI

InChI=1S/C28H27N5O2/c1-3-4-16-35-21-14-12-20(13-15-21)33-26(29)24(28(34)30-19-9-7-8-18(2)17-19)25-27(33)32-23-11-6-5-10-22(23)31-25/h5-15,17H,3-4,16,29H2,1-2H3,(H,30,34)