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

Systemtic Name: 2-azanyl-N-[(4-chlorophenyl)methyl]-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-[(4-chlorophenyl)methyl]-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-[(4-chlorophenyl)methyl]-1-hexyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-[(4-chlorophenyl)methyl]-1-hexylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-(4-chlorobenzyl)-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C24H26ClN5O MolecularWeight: 435.94914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NCC4=CC=C(C=C4)Cl)N

Isomeric SMILES

CCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NCC4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C24H26ClN5O/c1-2-3-4-7-14-30-22(26)20(24(31)27-15-16-10-12-17(25)13-11-16)21-23(30)29-19-9-6-5-8-18(19)28-21/h5-6,8-13H,2-4,7,14-15,26H2,1H3,(H,27,31)