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

Systemtic Name: 2-azanyl-1-[(4-chlorophenyl)methyl]-N-heptyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-[(4-chlorophenyl)methyl]-N-heptyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-[(4-chlorophenyl)methyl]-N-heptyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-[(4-chlorophenyl)methyl]-N-heptylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(4-chlorobenzyl)-N-heptyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H28ClN5O MolecularWeight: 449.97572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=C(C=C4)Cl)N

Isomeric SMILES

CCCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C25H28ClN5O/c1-2-3-4-5-8-15-28-25(32)21-22-24(30-20-10-7-6-9-19(20)29-22)31(23(21)27)16-17-11-13-18(26)14-12-17/h6-7,9-14H,2-5,8,15-16,27H2,1H3,(H,28,32)