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

Systemtic Name: 2-azanyl-1-(4-methylphenyl)-N-(4-phenylbutan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-(1-methyl-3-phenyl-propyl)-1-(p-tolyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(4-methylphenyl)-N-(4-phenylbutan-2-yl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(4-methylphenyl)-N-(4-phenylbutan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-(1-methyl-3-phenyl-propyl)-1-(p-tolyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C28H27N5O MolecularWeight: 449.54688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H27N5O/c1-18-12-16-21(17-13-18)33-26(29)24(25-27(33)32-23-11-7-6-10-22(23)31-25)28(34)30-19(2)14-15-20-8-4-3-5-9-20/h3-13,16-17,19H,14-15,29H2,1-2H3,(H,30,34)