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

Systemtic Name: 2-azanyl-1-cyclohexyl-N-[(4-methylphenyl)methyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-cyclohexyl-N-(p-tolylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-cyclohexyl-N-[(4-methylphenyl)methyl]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-cyclohexyl-N-[(4-methylphenyl)methyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-cyclohexyl-N-(4-methylbenzyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H27N5O MolecularWeight: 413.51478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5CCCCC5)N

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5CCCCC5)N

InChI

InChI=1S/C25H27N5O/c1-16-11-13-17(14-12-16)15-27-25(31)21-22-24(29-20-10-6-5-9-19(20)28-22)30(23(21)26)18-7-3-2-4-8-18/h5-6,9-14,18H,2-4,7-8,15,26H2,1H3,(H,27,31)