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

Systemtic Name: 2-azanyl-N-(2,5-dimethylphenyl)-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-(2,5-dimethylphenyl)-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-(2,5-dimethylphenyl)-1-hexyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-(2,5-dimethylphenyl)-1-hexylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-(2,5-dimethylphenyl)-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H29N5O MolecularWeight: 415.53066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NC4=C(C=CC(=C4)C)C)N

Isomeric SMILES

CCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NC4=C(C=CC(=C4)C)C)N

InChI

InChI=1S/C25H29N5O/c1-4-5-6-9-14-30-23(26)21(25(31)29-20-15-16(2)12-13-17(20)3)22-24(30)28-19-11-8-7-10-18(19)27-22/h7-8,10-13,15H,4-6,9,14,26H2,1-3H3,(H,29,31)