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

Systemtic Name: 2-azanyl-N-(4-chlorophenyl)-1-pentyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-(4-chlorophenyl)-1-pentyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-(4-chlorophenyl)-1-pentyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-(4-chlorophenyl)-1-pentylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-amyl-N-(4-chlorophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C22H22ClN5O MolecularWeight: 407.89598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NC4=CC=C(C=C4)Cl)N

Isomeric SMILES

CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NC4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C22H22ClN5O/c1-2-3-6-13-28-20(24)18(22(29)25-15-11-9-14(23)10-12-15)19-21(28)27-17-8-5-4-7-16(17)26-19/h4-5,7-12H,2-3,6,13,24H2,1H3,(H,25,29)