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

Systemtic Name: 2-azanyl-1-(4-butylphenyl)-N-[(4-chlorophenyl)methyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(4-butylphenyl)-N-[(4-chlorophenyl)methyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(4-butylphenyl)-N-[(4-chlorophenyl)methyl]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(4-butylphenyl)-N-[(4-chlorophenyl)methyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(4-butylphenyl)-N-(4-chlorobenzyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C28H26ClN5O MolecularWeight: 483.99194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC=C(C=C5)Cl)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC=C(C=C5)Cl)N

InChI

InChI=1S/C28H26ClN5O/c1-2-3-6-18-11-15-21(16-12-18)34-26(30)24(28(35)31-17-19-9-13-20(29)14-10-19)25-27(34)33-23-8-5-4-7-22(23)32-25/h4-5,7-16H,2-3,6,17,30H2,1H3,(H,31,35)